1-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]-3,4-dihydro-1,4-benzodiazepine-2,5-dione

Systemtic Name: 1-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]-3,4-dihydro-1,4-benzodiazepine-2,5-dione Openeye Name: 1-[(4-isopentyloxy-3-methoxy-phenyl)methyl]-3,4-dihydro-1,4-benzodiazepine-2,5-dione CAS Name: 1-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]-3,4-dihydro-1,4-benzodiazepine-2,5-dione IUPAC Name: 1-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]-3,4-dihydro-1,4-benzodiazepine-2,5-dione Traditional Name: 1-(4-isoamoxy-3-methoxy-benzyl)-3,4-dihydro-1,4-benzodiazepine-2,5-quinone Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)CN2C(=O)CNC(=O)C3=CC=CC=C32)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)CN2C(=O)CNC(=O)C3=CC=CC=C32)OC

InChI

InChI=1S/C22H26N2O4/c1-15(2)10-11-28-19-9-8-16(12-20(19)27-3)14-24-18-7-5-4-6-17(18)22(26)23-13-21(24)25/h4-9,12,15H,10-11,13-14H2,1-3H3,(H,23,26)