1-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-4-methyl-3H-1,4-benzodiazepine-2,5-dione

Systemtic Name: 1-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-4-methyl-3H-1,4-benzodiazepine-2,5-dione Openeye Name: 1-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-4-methyl-3H-1,4-benzodiazepine-2,5-dione CAS Name: 1-[(E)-3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]-4-methyl-3H-1,4-benzodiazepine-2,5-dione IUPAC Name: 1-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-4-methyl-3H-1,4-benzodiazepine-2,5-dione Traditional Name: 1-[(E)-3-(1,3-benzodioxol-5-yl)acryloyl]-4-methyl-3H-1,4-benzodiazepine-2,5-quinone Formula: C20H16N2O5 MolecularWeight: 364.35144

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(=O)N(C2=CC=CC=C2C1=O)C(=O)C=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1CC(=O)N(C2=CC=CC=C2C1=O)C(=O)/C=C/C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H16N2O5/c1-21-11-19(24)22(15-5-3-2-4-14(15)20(21)25)18(23)9-7-13-6-8-16-17(10-13)27-12-26-16/h2-10H,11-12H2,1H3/b9-7+