[2-(4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxidanylidene-ethyl] 2-(2-methoxy-4-methyl-phenoxy)ethanoate

Systemtic Name: [2-(4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxidanylidene-ethyl] 2-(2-methoxy-4-methyl-phenoxy)ethanoate Openeye Name: [2-(4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxo-ethyl] 2-(2-methoxy-4-methyl-phenoxy)acetate CAS Name: 2-(2-methoxy-4-methylphenoxy)acetic 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] 2-(2-methoxy-4-methylphenoxy)acetate Traditional Name: 2-(2-methoxy-4-methyl-phenoxy)acetic acid [2-keto-2-(2-keto-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)ethyl] ester Formula: C22H24N2O6 MolecularWeight: 412.43576

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1C(=O)COC(=O)COC3=C(C=C(C=C3)C)OC

Isomeric SMILES

CC1CC(=O)NC2=CC=CC=C2N1C(=O)COC(=O)COC3=C(C=C(C=C3)C)OC

InChI

InChI=1S/C22H24N2O6/c1-14-8-9-18(19(10-14)28-3)29-13-22(27)30-12-21(26)24-15(2)11-20(25)23-16-6-4-5-7-17(16)24/h4-10,15H,11-13H2,1-3H3,(H,23,25)