[2-(4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxidanylidene-ethyl] 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: [2-(4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxidanylidene-ethyl] 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: [2-(4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxo-ethyl] 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-(4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxoethyl] ester IUPAC Name: [2-(4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxoethyl] 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-keto-2-(2-keto-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)ethyl] ester Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1C(=O)COC(=O)C3=C4C=C(C=CC4=NC5=C3CCCC5)C

Isomeric SMILES

CC1CC(=O)NC2=CC=CC=C2N1C(=O)COC(=O)C3=C4C=C(C=CC4=NC5=C3CCCC5)C

InChI

InChI=1S/C27H27N3O4/c1-16-11-12-21-19(13-16)26(18-7-3-4-8-20(18)28-21)27(33)34-15-25(32)30-17(2)14-24(31)29-22-9-5-6-10-23(22)30/h5-6,9-13,17H,3-4,7-8,14-15H2,1-2H3,(H,29,31)