[2-[(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-pentan-3-yl-azanium

Systemtic Name: [2-[(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-pentan-3-yl-azanium Openeye Name: 1-ethylpropyl-[2-[4-methoxy-3-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl]ammonium CAS Name: [2-[4-methoxy-3-(1-piperidinylsulfonyl)anilino]-2-oxoethyl]-pentan-3-ylammonium IUPAC Name: [2-(4-methoxy-3-piperidin-1-ylsulfonylanilino)-2-oxoethyl]-pentan-3-ylazanium Traditional Name: 1-ethylpropyl-[2-keto-2-(4-methoxy-3-piperidinosulfonyl-anilino)ethyl]ammonium Formula: C19H32N3O4S+ MolecularWeight: 398.54008

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH2+]CC(=O)NC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CCC(CC)[NH2+]CC(=O)NC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C19H31N3O4S/c1-4-15(5-2)20-14-19(23)21-16-9-10-17(26-3)18(13-16)27(24,25)22-11-7-6-8-12-22/h9-10,13,15,20H,4-8,11-12,14H2,1-3H3,(H,21,23)/p+1