Benzyl 2-(3-methylphenoxy)-1-[(2-nitroanilino)methyl]ethylcarbamate

HCID 68698461
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Basic information

Standard SMILES
Cc1cccc(OCC(CNc2ccccc2[N+](=O)[O-])NC(=O)OCc2ccccc2)c1
InChIKey
QASYTZKTXKVPPP-UHFFFAOYSA-N
Molecular formula
C24H25N3O5
Average molar mass
435.5 g/mol

Names & identifiers

Preferred name
Benzyl 2-(3-methylphenoxy)-1-[(2-nitroanilino)methyl]ethylcarbamate
IUPAC
benzyl N-[1-(3-methylphenoxy)-3-(2-nitroanilino)propan-2-yl]carbamate

Names & synonyms

SCHEMBL3574844QASYTZKTXKVPPP-UHFFFAOYSA-Nbenzyl 2-(3-methylphenoxy)-1-[(2-nitroanilino)methyl]ethylcarbamate

Database identifiers

PubChem CID
68698461

Properties

Computed structural properties

XLogP
5.6
Topological polar surface area
105 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
10
Heavy atoms
32

Related reactions

3 records
New reaction record

Compound notes

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