1-[(4-pentoxyphenyl)methyl]-3,4-dihydro-1,4-benzodiazepine-2,5-dione

Systemtic Name: 1-[(4-pentoxyphenyl)methyl]-3,4-dihydro-1,4-benzodiazepine-2,5-dione Openeye Name: 1-[(4-pentoxyphenyl)methyl]-3,4-dihydro-1,4-benzodiazepine-2,5-dione CAS Name: 1-[(4-pentoxyphenyl)methyl]-3,4-dihydro-1,4-benzodiazepine-2,5-dione IUPAC Name: 1-[(4-pentoxyphenyl)methyl]-3,4-dihydro-1,4-benzodiazepine-2,5-dione Traditional Name: 1-(4-amoxybenzyl)-3,4-dihydro-1,4-benzodiazepine-2,5-quinone Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)CN2C(=O)CNC(=O)C3=CC=CC=C32

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)CN2C(=O)CNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C21H24N2O3/c1-2-3-6-13-26-17-11-9-16(10-12-17)15-23-19-8-5-4-7-18(19)21(25)22-14-20(23)24/h4-5,7-12H,2-3,6,13-15H2,1H3,(H,22,25)