[1-[(diphenylmethyl)amino]-1-oxidanylidene-propan-2-yl] 2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanoate

Systemtic Name: [1-[(diphenylmethyl)amino]-1-oxidanylidene-propan-2-yl] 2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanoate Openeye Name: [2-(benzhydrylamino)-1-methyl-2-oxo-ethyl] 2-(2-acetyl-1H-isoquinolin-1-yl)acetate CAS Name: 2-(2-acetyl-1H-isoquinolin-1-yl)acetic acid [1-[(diphenylmethyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-(benzhydrylamino)-1-oxopropan-2-yl] 2-(2-acetyl-1H-isoquinolin-1-yl)acetate Traditional Name: 2-(2-acetyl-1H-isoquinolin-1-yl)acetic acid [2-(benzhydrylamino)-2-keto-1-methyl-ethyl] ester Formula: C29H28N2O4 MolecularWeight: 468.54362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)CC3C4=CC=CC=C4C=CN3C(=O)C

Isomeric SMILES

CC(C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)CC3C4=CC=CC=C4C=CN3C(=O)C

InChI

InChI=1S/C29H28N2O4/c1-20(29(34)30-28(23-12-5-3-6-13-23)24-14-7-4-8-15-24)35-27(33)19-26-25-16-10-9-11-22(25)17-18-31(26)21(2)32/h3-18,20,26,28H,19H2,1-2H3,(H,30,34)