[2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl]-ethyl-(4-methylpiperidin-1-yl)sulfonyl-azanium

Systemtic Name: [2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl]-ethyl-(4-methylpiperidin-1-yl)sulfonyl-azanium Openeye Name: [2-(4-acetamidoanilino)-2-oxo-ethyl]-ethyl-[(4-methyl-1-piperidyl)sulfonyl]ammonium CAS Name: [2-(4-acetamidoanilino)-2-oxoethyl]-ethyl-[(4-methyl-1-piperidinyl)sulfonyl]ammonium IUPAC Name: [2-(4-acetamidoanilino)-2-oxoethyl]-ethyl-(4-methylpiperidin-1-yl)sulfonylazanium Traditional Name: [2-(4-acetamidoanilino)-2-keto-ethyl]-ethyl-(4-methylpiperidino)sulfonyl-ammonium Formula: C18H29N4O4S+ MolecularWeight: 397.51226

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC(=O)NC1=CC=C(C=C1)NC(=O)C)S(=O)(=O)N2CCC(CC2)C

Isomeric SMILES

CC[NH+](CC(=O)NC1=CC=C(C=C1)NC(=O)C)S(=O)(=O)N2CCC(CC2)C

InChI

InChI=1S/C18H28N4O4S/c1-4-21(27(25,26)22-11-9-14(2)10-12-22)13-18(24)20-17-7-5-16(6-8-17)19-15(3)23/h5-8,14H,4,9-13H2,1-3H3,(H,19,23)(H,20,24)/p+1