O4-[3-[(1-oxidanylidene-2H-isoquinolin-4-yl)methyl]phenyl] O1-(phenylmethyl) piperidine-1,4-dicarboxylate

Systemtic Name: O4-[3-[(1-oxidanylidene-2H-isoquinolin-4-yl)methyl]phenyl] O1-(phenylmethyl) piperidine-1,4-dicarboxylate Openeye Name: O1-benzyl O4-[3-[(1-oxo-2H-isoquinolin-4-yl)methyl]phenyl] piperidine-1,4-dicarboxylate CAS Name: piperidine-1,4-dicarboxylic acid O4-[3-[(1-oxo-2H-isoquinolin-4-yl)methyl]phenyl] ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 4-O-[3-[(1-oxo-2H-isoquinolin-4-yl)methyl]phenyl] piperidine-1,4-dicarboxylate Traditional Name: piperidine-1,4-dicarboxylic acid O1-benzyl ester O4-[3-[(1-keto-2H-isoquinolin-4-yl)methyl]phenyl] ester Formula: C30H28N2O5 MolecularWeight: 496.55372

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OC2=CC=CC(=C2)CC3=CNC(=O)C4=CC=CC=C43)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)OC2=CC=CC(=C2)CC3=CNC(=O)C4=CC=CC=C43)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C30H28N2O5/c33-28-27-12-5-4-11-26(27)24(19-31-28)17-22-9-6-10-25(18-22)37-29(34)23-13-15-32(16-14-23)30(35)36-20-21-7-2-1-3-8-21/h1-12,18-19,23H,13-17,20H2,(H,31,33)