N-[2-[3-(6-chloranylnaphthalen-2-yl)sulfonylpropanoyl]-1,1-dimethyl-4-(2-methylpyridin-4-yl)piperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-[2-[3-(6-chloranylnaphthalen-2-yl)sulfonylpropanoyl]-1,1-dimethyl-4-(2-methylpyridin-4-yl)piperazin-1-ium-2-yl]ethanamide Openeye Name: N-[2-[3-[(6-chloro-2-naphthyl)sulfonyl]propanoyl]-1,1-dimethyl-4-(2-methyl-4-pyridyl)piperazin-1-ium-2-yl]acetamide CAS Name: N-[2-[3-[(6-chloro-2-naphthalenyl)sulfonyl]-1-oxopropyl]-1,1-dimethyl-4-(2-methyl-4-pyridinyl)-2-piperazin-1-iumyl]acetamide IUPAC Name: N-[2-[3-(6-chloronaphthalen-2-yl)sulfonylpropanoyl]-1,1-dimethyl-4-(2-methylpyridin-4-yl)piperazin-1-ium-2-yl]acetamide Traditional Name: N-[2-[3-[(6-chloro-2-naphthyl)sulfonyl]propanoyl]-1,1-dimethyl-4-(2-methyl-4-pyridyl)piperazin-1-ium-2-yl]acetamide Formula: C27H32ClN4O4S+ MolecularWeight: 544.08538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)N2CC[N+](C(C2)(C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl)NC(=O)C)(C)C

Isomeric SMILES

CC1=NC=CC(=C1)N2CC[N+](C(C2)(C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl)NC(=O)C)(C)C

InChI

InChI=1S/C27H31ClN4O4S/c1-19-15-24(9-11-29-19)31-12-13-32(3,4)27(18-31,30-20(2)33)26(34)10-14-37(35,36)25-8-6-21-16-23(28)7-5-22(21)17-25/h5-9,11,15-17H,10,12-14,18H2,1-4H3/p+1