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

Systemtic Name: N-phenethyl-1-piperidin-1-yl-isoquinoline-4-carboxamide Openeye Name: N-phenethyl-1-(1-piperidyl)isoquinoline-4-carboxamide CAS Name: N-phenethyl-1-(1-piperidinyl)-4-isoquinolinecarboxamide IUPAC Name: N-phenethyl-1-piperidin-1-ylisoquinoline-4-carboxamide Traditional Name: N-phenethyl-1-piperidino-isoquinoline-4-carboxamide Formula: C23H25N3O MolecularWeight: 359.4641

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3O/c27-23(24-14-13-18-9-3-1-4-10-18)21-17-25-22(26-15-7-2-8-16-26)20-12-6-5-11-19(20)21/h1,3-6,9-12,17H,2,7-8,13-16H2,(H,24,27)