1-(4-chlorophenyl)carbonyl-N-(5-piperidin-1-ylisoquinolin-8-yl)piperidine-4-carboxamide

Systemtic Name: 1-(4-chlorophenyl)carbonyl-N-(5-piperidin-1-ylisoquinolin-8-yl)piperidine-4-carboxamide Openeye Name: 1-(4-chlorobenzoyl)-N-[5-(1-piperidyl)-8-isoquinolyl]piperidine-4-carboxamide CAS Name: 1-[(4-chlorophenyl)-oxomethyl]-N-[5-(1-piperidinyl)-8-isoquinolinyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-chlorobenzoyl)-N-(5-piperidin-1-ylisoquinolin-8-yl)piperidine-4-carboxamide Traditional Name: 1-(4-chlorobenzoyl)-N-(5-piperidino-8-isoquinolyl)isonipecotamide Formula: C27H29ClN4O2 MolecularWeight: 476.99776

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)C4CCN(CC4)C(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)C4CCN(CC4)C(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H29ClN4O2/c28-21-6-4-20(5-7-21)27(34)32-16-11-19(12-17-32)26(33)30-24-8-9-25(31-14-2-1-3-15-31)22-10-13-29-18-23(22)24/h4-10,13,18-19H,1-3,11-12,14-17H2,(H,30,33)