methyl 2-[5-(2-fluorophenyl)-2-oxidanylidene-3-(phenylmethoxycarbonylamino)-3H-1,4-benzodiazepin-1-yl]ethanoate

Systemtic Name: methyl 2-[5-(2-fluorophenyl)-2-oxidanylidene-3-(phenylmethoxycarbonylamino)-3H-1,4-benzodiazepin-1-yl]ethanoate Openeye Name: methyl 2-[3-(benzyloxycarbonylamino)-5-(2-fluorophenyl)-2-oxo-3H-1,4-benzodiazepin-1-yl]acetate CAS Name: 2-[5-(2-fluorophenyl)-2-oxo-3-(phenylmethoxycarbonylamino)-3H-1,4-benzodiazepin-1-yl]acetic acid methyl ester IUPAC Name: methyl 2-[5-(2-fluorophenyl)-2-oxo-3-(phenylmethoxycarbonylamino)-3H-1,4-benzodiazepin-1-yl]acetate Traditional Name: 2-[3-(benzyloxycarbonylamino)-5-(2-fluorophenyl)-2-keto-3H-1,4-benzodiazepin-1-yl]acetic acid methyl ester Formula: C26H22FN3O5 MolecularWeight: 475.468383

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)OCC3=CC=CC=C3)C4=CC=CC=C4F

Isomeric SMILES

COC(=O)CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)OCC3=CC=CC=C3)C4=CC=CC=C4F

InChI

InChI=1S/C26H22FN3O5/c1-34-22(31)15-30-21-14-8-6-12-19(21)23(18-11-5-7-13-20(18)27)28-24(25(30)32)29-26(33)35-16-17-9-3-2-4-10-17/h2-14,24H,15-16H2,1H3,(H,29,33)