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

Systemtic Name: 1-[(3-methoxy-4-pentoxy-phenyl)methyl]-3,4-dihydro-1,4-benzodiazepine-2,5-dione Openeye Name: 1-[(3-methoxy-4-pentoxy-phenyl)methyl]-3,4-dihydro-1,4-benzodiazepine-2,5-dione CAS Name: 1-[(3-methoxy-4-pentoxyphenyl)methyl]-3,4-dihydro-1,4-benzodiazepine-2,5-dione IUPAC Name: 1-[(3-methoxy-4-pentoxyphenyl)methyl]-3,4-dihydro-1,4-benzodiazepine-2,5-dione Traditional Name: 1-(4-amoxy-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:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O4/c1-3-4-7-12-28-19-11-10-16(13-20(19)27-2)15-24-18-9-6-5-8-17(18)22(26)23-14-21(24)25/h5-6,8-11,13H,3-4,7,12,14-15H2,1-2H3,(H,23,26)