N-[1-(furan-2-ylmethylcarbamoyl)piperidin-3-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-[1-(furan-2-ylmethylcarbamoyl)piperidin-3-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-[1-(2-furylmethylcarbamoyl)-3-piperidyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-[1-[(2-furanylmethylamino)-oxomethyl]-3-piperidinyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-[1-(furan-2-ylmethylcarbamoyl)piperidin-3-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-[1-(2-furfurylcarbamoyl)-3-piperidyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)NCC2=CC=CO2)NC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CC(CN(C1)C(=O)NCC2=CC=CO2)NC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H26N4O3/c26-20(22-13-19-8-4-12-28-19)24-10-3-7-18(15-24)23-21(27)25-11-9-16-5-1-2-6-17(16)14-25/h1-2,4-6,8,12,18H,3,7,9-11,13-15H2,(H,22,26)(H,23,27)