N-(furan-2-ylmethyl)-1-piperidin-1-yl-isoquinoline-4-carboxamide

Systemtic Name: N-(furan-2-ylmethyl)-1-piperidin-1-yl-isoquinoline-4-carboxamide Openeye Name: N-(2-furylmethyl)-1-(1-piperidyl)isoquinoline-4-carboxamide CAS Name: N-(2-furanylmethyl)-1-(1-piperidinyl)-4-isoquinolinecarboxamide IUPAC Name: N-(furan-2-ylmethyl)-1-piperidin-1-ylisoquinoline-4-carboxamide Traditional Name: N-(2-furfuryl)-1-piperidino-isoquinoline-4-carboxamide Formula: C20H21N3O2 MolecularWeight: 335.39964

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC=C(C3=CC=CC=C32)C(=O)NCC4=CC=CO4

Isomeric SMILES

C1CCN(CC1)C2=NC=C(C3=CC=CC=C32)C(=O)NCC4=CC=CO4

InChI

InChI=1S/C20H21N3O2/c24-20(22-13-15-7-6-12-25-15)18-14-21-19(23-10-4-1-5-11-23)17-9-3-2-8-16(17)18/h2-3,6-9,12,14H,1,4-5,10-11,13H2,(H,22,24)