3-[2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione

Systemtic Name: 3-[2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione Openeye Name: 3-[2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione CAS Name: 3-[2-[4-(3-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione IUPAC Name: 3-[2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione Traditional Name: 3-[2-keto-2-[4-(3-methoxyphenyl)piperazino]ethyl]-3,4-dihydro-1H-1,4-benzodiazepine-2,5-quinone Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)CC3C(=O)NC4=CC=CC=C4C(=O)N3

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)CC3C(=O)NC4=CC=CC=C4C(=O)N3

InChI

InChI=1S/C22H24N4O4/c1-30-16-6-4-5-15(13-16)25-9-11-26(12-10-25)20(27)14-19-22(29)23-18-8-3-2-7-17(18)21(28)24-19/h2-8,13,19H,9-12,14H2,1H3,(H,23,29)(H,24,28)