N2-(4-chlorophenyl)-N3-[(1-pyridin-4-ylpiperidin-4-yl)methyl]-3,4-dihydro-1H-isoquinoline-2,3-dicarboxamide

Systemtic Name: N2-(4-chlorophenyl)-N3-[(1-pyridin-4-ylpiperidin-4-yl)methyl]-3,4-dihydro-1H-isoquinoline-2,3-dicarboxamide Openeye Name: N2-(4-chlorophenyl)-N3-[[1-(4-pyridyl)-4-piperidyl]methyl]-3,4-dihydro-1H-isoquinoline-2,3-dicarboxamide CAS Name: N2-(4-chlorophenyl)-N3-[(1-pyridin-4-yl-4-piperidinyl)methyl]-3,4-dihydro-1H-isoquinoline-2,3-dicarboxamide IUPAC Name: 2-N-(4-chlorophenyl)-3-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]-3,4-dihydro-1H-isoquinoline-2,3-dicarboxamide Traditional Name: N-(4-chlorophenyl)-N'-[[1-(4-pyridyl)-4-piperidyl]methyl]-3,4-dihydro-1H-isoquinoline-2,3-dicarboxamide Formula: C28H30ClN5O2 MolecularWeight: 504.0231

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC(=O)C2CC3=CC=CC=C3CN2C(=O)NC4=CC=C(C=C4)Cl)C5=CC=NC=C5

Isomeric SMILES

C1CN(CCC1CNC(=O)C2CC3=CC=CC=C3CN2C(=O)NC4=CC=C(C=C4)Cl)C5=CC=NC=C5

InChI

InChI=1S/C28H30ClN5O2/c29-23-5-7-24(8-6-23)32-28(36)34-19-22-4-2-1-3-21(22)17-26(34)27(35)31-18-20-11-15-33(16-12-20)25-9-13-30-14-10-25/h1-10,13-14,20,26H,11-12,15-19H2,(H,31,35)(H,32,36)