1-[2-[(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[2-[(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[2-(2-methyl-5-morpholinosulfonyl-anilino)-2-oxo-ethyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[2-[2-methyl-5-(4-morpholinylsulfonyl)anilino]-2-oxoethyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[2-(2-methyl-5-morpholin-4-ylsulfonylanilino)-2-oxoethyl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[2-keto-2-(2-methyl-5-morpholinosulfonyl-anilino)ethyl]pyridin-1-ium-3-carboxamide Formula: C19H23N4O5S+ MolecularWeight: 419.47472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C[N+]3=CC=CC(=C3)C(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C[N+]3=CC=CC(=C3)C(=O)N

InChI

InChI=1S/C19H22N4O5S/c1-14-4-5-16(29(26,27)23-7-9-28-10-8-23)11-17(14)21-18(24)13-22-6-2-3-15(12-22)19(20)25/h2-6,11-12H,7-10,13H2,1H3,(H2-,20,21,24,25)/p+1