N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-[4-(4-methylpiperidino)sulfonylphenyl]-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C18H28N3O3S+ MolecularWeight: 366.49822

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C[NH+]3CCCC3

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C[NH+]3CCCC3

InChI

InChI=1S/C18H27N3O3S/c1-15-8-12-21(13-9-15)25(23,24)17-6-4-16(5-7-17)19-18(22)14-20-10-2-3-11-20/h4-7,15H,2-3,8-14H2,1H3,(H,19,22)/p+1