4-[(4-methoxyphenyl)methyl]-7-nitro-3-propan-2-yl-1,3-dihydro-1,4-benzodiazepine-2,5-dione

Systemtic Name: 4-[(4-methoxyphenyl)methyl]-7-nitro-3-propan-2-yl-1,3-dihydro-1,4-benzodiazepine-2,5-dione Openeye Name: 3-isopropyl-4-[(4-methoxyphenyl)methyl]-7-nitro-1,3-dihydro-1,4-benzodiazepine-2,5-dione CAS Name: 4-[(4-methoxyphenyl)methyl]-7-nitro-3-propan-2-yl-1,3-dihydro-1,4-benzodiazepine-2,5-dione IUPAC Name: 4-[(4-methoxyphenyl)methyl]-7-nitro-3-propan-2-yl-1,3-dihydro-1,4-benzodiazepine-2,5-dione Traditional Name: 3-isopropyl-7-nitro-4-p-anisyl-1,3-dihydro-1,4-benzodiazepine-2,5-quinone Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N1CC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N1CC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H21N3O5/c1-12(2)18-19(24)21-17-9-6-14(23(26)27)10-16(17)20(25)22(18)11-13-4-7-15(28-3)8-5-13/h4-10,12,18H,11H2,1-3H3,(H,21,24)