N-[2-(4-chlorophenyl)ethyl]-1-piperidin-1-yl-isoquinoline-4-carboxamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-1-piperidin-1-yl-isoquinoline-4-carboxamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-1-(1-piperidyl)isoquinoline-4-carboxamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-1-(1-piperidinyl)-4-isoquinolinecarboxamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-1-piperidin-1-ylisoquinoline-4-carboxamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-1-piperidino-isoquinoline-4-carboxamide Formula: C23H24ClN3O MolecularWeight: 393.90916

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC=C(C3=CC=CC=C32)C(=O)NCCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(CC1)C2=NC=C(C3=CC=CC=C32)C(=O)NCCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H24ClN3O/c24-18-10-8-17(9-11-18)12-13-25-23(28)21-16-26-22(27-14-4-1-5-15-27)20-7-3-2-6-19(20)21/h2-3,6-11,16H,1,4-5,12-15H2,(H,25,28)