N-phenyl-1-piperidin-1-yl-isoquinoline-4-carboxamide

Systemtic Name: N-phenyl-1-piperidin-1-yl-isoquinoline-4-carboxamide Openeye Name: N-phenyl-1-(1-piperidyl)isoquinoline-4-carboxamide CAS Name: N-phenyl-1-(1-piperidinyl)-4-isoquinolinecarboxamide IUPAC Name: N-phenyl-1-piperidin-1-ylisoquinoline-4-carboxamide Traditional Name: N-phenyl-1-piperidino-isoquinoline-4-carboxamide Formula: C21H21N3O MolecularWeight: 331.41094

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC=C(C3=CC=CC=C32)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=NC=C(C3=CC=CC=C32)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C21H21N3O/c25-21(23-16-9-3-1-4-10-16)19-15-22-20(24-13-7-2-8-14-24)18-12-6-5-11-17(18)19/h1,3-6,9-12,15H,2,7-8,13-14H2,(H,23,25)