2-(1-methyl-3-oxidanylidene-4-phenethyl-7-phenylmethoxycarbonyl-2,5-dihydro-1,4-benzodiazepin-2-yl)ethanoate

Systemtic Name: 2-(1-methyl-3-oxidanylidene-4-phenethyl-7-phenylmethoxycarbonyl-2,5-dihydro-1,4-benzodiazepin-2-yl)ethanoate Openeye Name: 2-(7-benzyloxycarbonyl-1-methyl-3-oxo-4-phenethyl-2,5-dihydro-1,4-benzodiazepin-2-yl)acetate CAS Name: 2-(1-methyl-3-oxo-4-phenethyl-7-phenylmethoxycarbonyl-2,5-dihydro-1,4-benzodiazepin-2-yl)acetate IUPAC Name: 2-(1-methyl-3-oxo-4-phenethyl-7-phenylmethoxycarbonyl-2,5-dihydro-1,4-benzodiazepin-2-yl)acetate Traditional Name: 2-(7-carbobenzoxy-3-keto-1-methyl-4-phenethyl-2,5-dihydro-1,4-benzodiazepin-2-yl)acetate Formula: C28H27N2O5- MolecularWeight: 471.52438

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(=O)N(CC2=C1C=CC(=C2)C(=O)OCC3=CC=CC=C3)CCC4=CC=CC=C4)CC(=O)[O-]

Isomeric SMILES

CN1C(C(=O)N(CC2=C1C=CC(=C2)C(=O)OCC3=CC=CC=C3)CCC4=CC=CC=C4)CC(=O)[O-]

InChI

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