1-[2-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-[4-[(4-methyl-1-piperidyl)sulfonyl]anilino]-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[4-[(4-methyl-1-piperidinyl)sulfonyl]anilino]-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-[4-(4-methylpiperidin-1-yl)sulfonylanilino]-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-keto-2-[4-(4-methylpiperidino)sulfonylanilino]ethyl]piperidin-1-ium-4-carboxamide Formula: C20H31N4O4S+ MolecularWeight: 423.54954

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C[NH+]3CCC(CC3)C(=O)N

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C[NH+]3CCC(CC3)C(=O)N

InChI

InChI=1S/C20H30N4O4S/c1-15-6-12-24(13-7-15)29(27,28)18-4-2-17(3-5-18)22-19(25)14-23-10-8-16(9-11-23)20(21)26/h2-5,15-16H,6-14H2,1H3,(H2,21,26)(H,22,25)/p+1