N-cyclopentyl-6-[4-(phenylmethyl)piperidin-1-yl]pyridin-1-ium-3-carboxamide

Systemtic Name: N-cyclopentyl-6-[4-(phenylmethyl)piperidin-1-yl]pyridin-1-ium-3-carboxamide Openeye Name: 6-(4-benzyl-1-piperidyl)-N-cyclopentyl-pyridin-1-ium-3-carboxamide CAS Name: N-cyclopentyl-6-[4-(phenylmethyl)-1-piperidinyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 6-(4-benzylpiperidin-1-yl)-N-cyclopentylpyridin-1-ium-3-carboxamide Traditional Name: 6-(4-benzylpiperidino)-N-cyclopentyl-pyridin-1-ium-3-carboxamide Formula: C23H30N3O+ MolecularWeight: 364.5038

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C2=C[NH+]=C(C=C2)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)NC(=O)C2=C[NH+]=C(C=C2)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H29N3O/c27-23(25-21-8-4-5-9-21)20-10-11-22(24-17-20)26-14-12-19(13-15-26)16-18-6-2-1-3-7-18/h1-3,6-7,10-11,17,19,21H,4-5,8-9,12-16H2,(H,25,27)/p+1