bis(phenylmethyl) 5-(1,2,3,4-tetrahydroisoquinolin-3-ylcarbonylamino)benzene-1,3-dicarboxylate

Systemtic Name: bis(phenylmethyl) 5-(1,2,3,4-tetrahydroisoquinolin-3-ylcarbonylamino)benzene-1,3-dicarboxylate Openeye Name: dibenzyl 5-(1,2,3,4-tetrahydroisoquinoline-3-carbonylamino)benzene-1,3-dicarboxylate CAS Name: 5-[[oxo(1,2,3,4-tetrahydroisoquinolin-3-yl)methyl]amino]benzene-1,3-dicarboxylic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 5-(1,2,3,4-tetrahydroisoquinoline-3-carbonylamino)benzene-1,3-dicarboxylate Traditional Name: 5-(1,2,3,4-tetrahydroisoquinoline-3-carbonylamino)benzene-1,3-dicarboxylic acid dibenzyl ester Formula: C32H28N2O5 MolecularWeight: 520.57512

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NCC2=CC=CC=C21)C(=O)NC3=CC(=CC(=C3)C(=O)OCC4=CC=CC=C4)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1C(NCC2=CC=CC=C21)C(=O)NC3=CC(=CC(=C3)C(=O)OCC4=CC=CC=C4)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C32H28N2O5/c35-30(29-18-24-13-7-8-14-25(24)19-33-29)34-28-16-26(31(36)38-20-22-9-3-1-4-10-22)15-27(17-28)32(37)39-21-23-11-5-2-6-12-23/h1-17,29,33H,18-21H2,(H,34,35)