1-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]-7-methyl-3,4-dihydro-1,4-benzodiazepine-2,5-dione

Systemtic Name: 1-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]-7-methyl-3,4-dihydro-1,4-benzodiazepine-2,5-dione Openeye Name: 1-[(4-isopentyloxy-3-methoxy-phenyl)methyl]-7-methyl-3,4-dihydro-1,4-benzodiazepine-2,5-dione CAS Name: 1-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]-7-methyl-3,4-dihydro-1,4-benzodiazepine-2,5-dione IUPAC Name: 1-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]-7-methyl-3,4-dihydro-1,4-benzodiazepine-2,5-dione Traditional Name: 1-(4-isoamoxy-3-methoxy-benzyl)-7-methyl-3,4-dihydro-1,4-benzodiazepine-2,5-quinone Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)CNC2=O)CC3=CC(=C(C=C3)OCCC(C)C)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)CNC2=O)CC3=CC(=C(C=C3)OCCC(C)C)OC

InChI

InChI=1S/C23H28N2O4/c1-15(2)9-10-29-20-8-6-17(12-21(20)28-4)14-25-19-7-5-16(3)11-18(19)23(27)24-13-22(25)26/h5-8,11-12,15H,9-10,13-14H2,1-4H3,(H,24,27)