(phenylmethyl) (2S)-2-(2-methoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-4-phenethyl-2,5-dihydro-1H-1,4-benzodiazepine-7-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-(2-methoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-4-phenethyl-2,5-dihydro-1H-1,4-benzodiazepine-7-carboxylate Openeye Name: benzyl (2S)-2-(2-methoxy-2-oxo-ethyl)-3-oxo-4-phenethyl-2,5-dihydro-1H-1,4-benzodiazepine-7-carboxylate CAS Name: (2S)-2-(2-methoxy-2-oxoethyl)-3-oxo-4-phenethyl-2,5-dihydro-1H-1,4-benzodiazepine-7-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-(2-methoxy-2-oxoethyl)-3-oxo-4-phenethyl-2,5-dihydro-1H-1,4-benzodiazepine-7-carboxylate Traditional Name: (2S)-3-keto-2-(2-keto-2-methoxy-ethyl)-4-phenethyl-2,5-dihydro-1H-1,4-benzodiazepine-7-carboxylic acid benzyl ester Formula: C28H28N2O5 MolecularWeight: 472.53232

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C(=O)N(CC2=C(N1)C=CC(=C2)C(=O)OCC3=CC=CC=C3)CCC4=CC=CC=C4

Isomeric SMILES

COC(=O)C[C@H]1C(=O)N(CC2=C(N1)C=CC(=C2)C(=O)OCC3=CC=CC=C3)CCC4=CC=CC=C4

InChI

InChI=1S/C28H28N2O5/c1-34-26(31)17-25-27(32)30(15-14-20-8-4-2-5-9-20)18-23-16-22(12-13-24(23)29-25)28(33)35-19-21-10-6-3-7-11-21/h2-13,16,25,29H,14-15,17-19H2,1H3/t25-/m0/s1