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

Systemtic Name: [2-[(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-pentyl-propan-2-yl-azanium Openeye Name: isopropyl-[2-[4-methoxy-3-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl]-pentyl-ammonium CAS Name: [2-[4-methoxy-3-(1-piperidinylsulfonyl)anilino]-2-oxoethyl]-pentyl-propan-2-ylammonium IUPAC Name: [2-(4-methoxy-3-piperidin-1-ylsulfonylanilino)-2-oxoethyl]-pentyl-propan-2-ylazanium Traditional Name: amyl-isopropyl-[2-keto-2-(4-methoxy-3-piperidinosulfonyl-anilino)ethyl]ammonium Formula: C22H38N3O4S+ MolecularWeight: 440.61982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[NH+](CC(=O)NC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCCC2)C(C)C

Isomeric SMILES

CCCCC[NH+](CC(=O)NC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCCC2)C(C)C

InChI

InChI=1S/C22H37N3O4S/c1-5-6-8-13-24(18(2)3)17-22(26)23-19-11-12-20(29-4)21(16-19)30(27,28)25-14-9-7-10-15-25/h11-12,16,18H,5-10,13-15,17H2,1-4H3,(H,23,26)/p+1