diethyl 2-(4-methyl-5-oxidanylidene-1,3-dihydro-1,4-benzodiazepin-2-ylidene)propanedioate

Systemtic Name: diethyl 2-(4-methyl-5-oxidanylidene-1,3-dihydro-1,4-benzodiazepin-2-ylidene)propanedioate Openeye Name: diethyl 2-(4-methyl-5-oxo-1,3-dihydro-1,4-benzodiazepin-2-ylidene)propanedioate CAS Name: 2-(4-methyl-5-oxo-1,3-dihydro-1,4-benzodiazepin-2-ylidene)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(4-methyl-5-oxo-1,3-dihydro-1,4-benzodiazepin-2-ylidene)propanedioate Traditional Name: 2-(5-keto-4-methyl-1,3-dihydro-1,4-benzodiazepin-2-ylidene)malonic acid diethyl ester Formula: C17H20N2O5 MolecularWeight: 332.3511

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1CN(C(=O)C2=CC=CC=C2N1)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=C1CN(C(=O)C2=CC=CC=C2N1)C)C(=O)OCC

InChI

InChI=1S/C17H20N2O5/c1-4-23-16(21)14(17(22)24-5-2)13-10-19(3)15(20)11-8-6-7-9-12(11)18-13/h6-9,18H,4-5,10H2,1-3H3