1H-Indole-3-methanamine, N-butyl-5-methoxy-2-methyl-1-phenyl-, (Z)-2-butenedioate (1:1)
Basic information
- CAS
56825-59-3- Standard SMILES
CCCCNCc1c(C)n(-c2ccccc2)c2ccc(OC)cc12.O=C(O)/C=C/C(=O)O- InChIKey
FVBSEJCXZIUGDF-WLHGVMLRSA-N- Molecular formula
- C25H30N2O5
- Average molar mass
- 438.5 g/mol
- Monoisotopic mass
- 438.21547206
Names & identifiers
- Preferred name
- 1H-Indole-3-methanamine, N-butyl-5-methoxy-2-methyl-1-phenyl-, (Z)-2-butenedioate (1:1)
- IUPAC
- (E)-but-2-enedioic acid;N-[(5-methoxy-2-methyl-1-phenylindol-3-yl)methyl]butan-1-amine
Names & synonyms
1H-Indole-3-methanamine, N-butyl-5-methoxy-2-methyl-1-phenyl-, (Z)-2-butenedioate (1:1)56825-59-3RefChem:1058218N-Butyl-5-methoxy-2-methyl-1-phenyl-1H-indole-3-methanamine (Z)-2-butenedioate (1:1)Maleate de phenyl-1 methyl-2 butylaminomethyl-3 methoxy-5 indole [French]Maleate de phenyl-1 methyl-2 butylaminomethyl-3 methoxy-5 indole
Database identifiers
- CAS
56825-59-3- PubChem CID
- 6446320
Properties
Computed structural properties
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 488
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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