N-(4-ethoxyphenyl)-1-piperidin-1-yl-isoquinoline-4-carboxamide

Systemtic Name: N-(4-ethoxyphenyl)-1-piperidin-1-yl-isoquinoline-4-carboxamide Openeye Name: N-(4-ethoxyphenyl)-1-(1-piperidyl)isoquinoline-4-carboxamide CAS Name: N-(4-ethoxyphenyl)-1-(1-piperidinyl)-4-isoquinolinecarboxamide IUPAC Name: N-(4-ethoxyphenyl)-1-piperidin-1-ylisoquinoline-4-carboxamide Traditional Name: 1-piperidino-N-p-phenetyl-isoquinoline-4-carboxamide Formula: C23H25N3O2 MolecularWeight: 375.4635

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CN=C(C3=CC=CC=C32)N4CCCCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CN=C(C3=CC=CC=C32)N4CCCCC4

InChI

InChI=1S/C23H25N3O2/c1-2-28-18-12-10-17(11-13-18)25-23(27)21-16-24-22(26-14-6-3-7-15-26)20-9-5-4-8-19(20)21/h4-5,8-13,16H,2-3,6-7,14-15H2,1H3,(H,25,27)