1-(1-propan-2-ylpiperidin-1-ium-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(1-propan-2-ylpiperidin-1-ium-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-(1-isopropylpiperidin-1-ium-4-yl)-N-(3-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-(1-propan-2-yl-4-piperidin-1-iumyl)-N-(3-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-(1-propan-2-ylpiperidin-1-ium-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-(1-isopropylpiperidin-1-ium-4-yl)-N-(3-pyridylmethyl)isonipecotamide Formula: C20H33N4O+ MolecularWeight: 345.50222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)N2CCC(CC2)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)N2CCC(CC2)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C20H32N4O/c1-16(2)23-12-7-19(8-13-23)24-10-5-18(6-11-24)20(25)22-15-17-4-3-9-21-14-17/h3-4,9,14,16,18-19H,5-8,10-13,15H2,1-2H3,(H,22,25)/p+1