N-[1-(2-azanylethyl)-3-(6-chloranylnaphthalen-2-yl)sulfonyl-1-(2-methylpyridin-4-yl)piperidin-1-ium-4-yl]propanamide

Systemtic Name: N-[1-(2-azanylethyl)-3-(6-chloranylnaphthalen-2-yl)sulfonyl-1-(2-methylpyridin-4-yl)piperidin-1-ium-4-yl]propanamide Openeye Name: N-[1-(2-aminoethyl)-3-[(6-chloro-2-naphthyl)sulfonyl]-1-(2-methyl-4-pyridyl)piperidin-1-ium-4-yl]propanamide CAS Name: N-[1-(2-aminoethyl)-3-[(6-chloro-2-naphthalenyl)sulfonyl]-1-(2-methyl-4-pyridinyl)-4-piperidin-1-iumyl]propanamide IUPAC Name: N-[1-(2-aminoethyl)-3-(6-chloronaphthalen-2-yl)sulfonyl-1-(2-methylpyridin-4-yl)piperidin-1-ium-4-yl]propanamide Traditional Name: N-[1-(2-aminoethyl)-3-[(6-chloro-2-naphthyl)sulfonyl]-1-(2-methyl-4-pyridyl)piperidin-1-ium-4-yl]propionamide Formula: C26H32ClN4O3S+ MolecularWeight: 516.07528

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1CC[N+](CC1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)(CCN)C4=CC(=NC=C4)C

Isomeric SMILES

CCC(=O)NC1CC[N+](CC1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)(CCN)C4=CC(=NC=C4)C

InChI

InChI=1S/C26H31ClN4O3S/c1-3-26(32)30-24-9-12-31(13-10-28,22-8-11-29-18(2)14-22)17-25(24)35(33,34)23-7-5-19-15-21(27)6-4-20(19)16-23/h4-8,11,14-16,24-25H,3,9-10,12-13,17,28H2,1-2H3/p+1