2-[(6-chloranylnaphthalen-2-yl)sulfonylmethyl]-1-(2-methylpyridin-4-yl)-N-piperidin-4-yl-pyrrolidin-1-ium-1-carboxamide

Systemtic Name: 2-[(6-chloranylnaphthalen-2-yl)sulfonylmethyl]-1-(2-methylpyridin-4-yl)-N-piperidin-4-yl-pyrrolidin-1-ium-1-carboxamide Openeye Name: 2-[(6-chloro-2-naphthyl)sulfonylmethyl]-1-(2-methyl-4-pyridyl)-N-(4-piperidyl)pyrrolidin-1-ium-1-carboxamide CAS Name: 2-[(6-chloro-2-naphthalenyl)sulfonylmethyl]-1-(2-methyl-4-pyridinyl)-N-(4-piperidinyl)-1-pyrrolidin-1-iumcarboxamide IUPAC Name: 2-[(6-chloronaphthalen-2-yl)sulfonylmethyl]-1-(2-methylpyridin-4-yl)-N-piperidin-4-ylpyrrolidin-1-ium-1-carboxamide Traditional Name: 2-[(6-chloro-2-naphthyl)sulfonylmethyl]-1-(2-methyl-4-pyridyl)-N-(4-piperidyl)pyrrolidin-1-ium-1-carboxamide Formula: C27H32ClN4O3S+ MolecularWeight: 528.08598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)[N+]2(CCCC2CS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl)C(=O)NC5CCNCC5

Isomeric SMILES

CC1=NC=CC(=C1)[N+]2(CCCC2CS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl)C(=O)NC5CCNCC5

InChI

InChI=1S/C27H31ClN4O3S/c1-19-15-24(10-13-30-19)32(27(33)31-23-8-11-29-12-9-23)14-2-3-25(32)18-36(34,35)26-7-5-20-16-22(28)6-4-21(20)17-26/h4-7,10,13,15-17,23,25,29H,2-3,8-9,11-12,14,18H2,1H3/p+1