(2-acetamido-6-anilino-3-hydroxy-7-methyl-5,8-dioxo-2,3-dihydro-1H-pyrrolo[1,2-a]indol-4-yl)methyl carbamate
Basic information
- CAS
20956-77-8- Standard SMILES
CC(=O)NC1Cn2c3c(c(COC(N)=O)c2C1O)C(=O)C(Nc1ccccc1)=C(C)C3=O- InChIKey
BPLYSIXRBSYYEI-UHFFFAOYSA-N- Molecular formula
- C22H22N4O6
- Average molar mass
- 438.4 g/mol
- Monoisotopic mass
- 438.15393443
Names & identifiers
- Preferred name
- (2-acetamido-6-anilino-3-hydroxy-7-methyl-5,8-dioxo-2,3-dihydro-1H-pyrrolo[1,2-a]indol-4-yl)methyl carbamate
- IUPAC
- (2-acetamido-6-anilino-3-hydroxy-7-methyl-5,8-dioxo-2,3-dihydro-1H-pyrrolo[1,2-a]indol-4-yl)methyl carbamate
Names & synonyms
20956-77-8NSC134720(2-acetamido-6-anilino-3-hydroxy-7-methyl-5,8-dioxo-2,3-dihydro-1H-pyrrolo[1,2-a]indol-4-yl)methyl carbamateDTXSID40943245NSC-134720(2-Acetamido-1-hydroxy-6-methyl-5,8-dioxo-7-(phenylamino)-2,3,5,8-tetrahydro-1H-pyrrolo[1,2-a]indol-9-yl)methyl carbamate(2-Acetamido-1-hydroxy-6-methyl-5,8-dioxo-7-(phenylamino)-2,3,5,8-tetrahydro-1H-pyrrolo[1,2-a]indol-9-yl)methylcarbamateAcetamide, N-[9-[[(aminocarbonyl)oxy]methyl]-2,3,5,8-tetrahydro-1-hydroxy-6-methyl-5,8-dioxo-7-(phenylamino)-1H-pyrrolo[1,2-a]indol-2-yl]-N-(7-Anilino-1-hydroxy-9-{[hydroxy(imino)methoxy]methyl}-6-methyl-5,8-dioxo-2,3,5,8-tetrahydro-1H-pyrrolo[1,2-a]indol-2-yl)ethanimidic acid
Database identifiers
- CAS
20956-77-8- PubChem CID
- 281827
- DTXSID
DTXSID40943245
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 153 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 851
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…