1-[1-[2-(1-methylpyrrol-3-yl)ethanoyl]piperidin-4-yl]-N-propan-2-yl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[1-[2-(1-methylpyrrol-3-yl)ethanoyl]piperidin-4-yl]-N-propan-2-yl-piperidin-1-ium-4-carboxamide Openeye Name: N-isopropyl-1-[1-[2-(1-methylpyrrol-3-yl)acetyl]-4-piperidyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[1-[2-(1-methyl-3-pyrrolyl)-1-oxoethyl]-4-piperidinyl]-N-propan-2-yl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[1-[2-(1-methylpyrrol-3-yl)acetyl]piperidin-4-yl]-N-propan-2-ylpiperidin-1-ium-4-carboxamide Traditional Name: N-isopropyl-1-[1-[2-(1-methylpyrrol-3-yl)acetyl]-4-piperidyl]piperidin-1-ium-4-carboxamide Formula: C21H35N4O2+ MolecularWeight: 375.5282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1CC[NH+](CC1)C2CCN(CC2)C(=O)CC3=CN(C=C3)C

Isomeric SMILES

CC(C)NC(=O)C1CC[NH+](CC1)C2CCN(CC2)C(=O)CC3=CN(C=C3)C

InChI

InChI=1S/C21H34N4O2/c1-16(2)22-21(27)18-5-10-24(11-6-18)19-7-12-25(13-8-19)20(26)14-17-4-9-23(3)15-17/h4,9,15-16,18-19H,5-8,10-14H2,1-3H3,(H,22,27)/p+1