(phenylmethyl) 6-phenylmethoxy-2-(2-phenylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylate

Systemtic Name: (phenylmethyl) 6-phenylmethoxy-2-(2-phenylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylate Openeye Name: benzyl 6-benzyloxy-2-(2-phenylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylate CAS Name: 2-(1-oxo-2-phenylpropyl)-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-phenylmethoxy-2-(2-phenylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylate Traditional Name: 6-benzoxy-2-hydratropoyl-3,4-dihydro-1H-isoquinoline-1-carboxylic acid benzyl ester Formula: C33H31NO4 MolecularWeight: 505.60354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C(=O)N2CCC3=C(C2C(=O)OCC4=CC=CC=C4)C=CC(=C3)OCC5=CC=CC=C5

Isomeric SMILES

CC(C1=CC=CC=C1)C(=O)N2CCC3=C(C2C(=O)OCC4=CC=CC=C4)C=CC(=C3)OCC5=CC=CC=C5

InChI

InChI=1S/C33H31NO4/c1-24(27-15-9-4-10-16-27)32(35)34-20-19-28-21-29(37-22-25-11-5-2-6-12-25)17-18-30(28)31(34)33(36)38-23-26-13-7-3-8-14-26/h2-18,21,24,31H,19-20,22-23H2,1H3