(phenylmethyl) 3-[1-methyl-2,5-bis(oxidanylidene)-3H-1,4-benzodiazepin-4-yl]propanoate

Systemtic Name: (phenylmethyl) 3-[1-methyl-2,5-bis(oxidanylidene)-3H-1,4-benzodiazepin-4-yl]propanoate Openeye Name: benzyl 3-(1-methyl-2,5-dioxo-3H-1,4-benzodiazepin-4-yl)propanoate CAS Name: 3-(1-methyl-2,5-dioxo-3H-1,4-benzodiazepin-4-yl)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(1-methyl-2,5-dioxo-3H-1,4-benzodiazepin-4-yl)propanoate Traditional Name: 3-(2,5-diketo-1-methyl-3H-1,4-benzodiazepin-4-yl)propionic acid benzyl ester Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CN(C(=O)C2=CC=CC=C21)CCC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CN1C(=O)CN(C(=O)C2=CC=CC=C21)CCC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H20N2O4/c1-21-17-10-6-5-9-16(17)20(25)22(13-18(21)23)12-11-19(24)26-14-15-7-3-2-4-8-15/h2-10H,11-14H2,1H3