cyclohexylmethyl-[2-[(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: cyclohexylmethyl-[2-[(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: cyclohexylmethyl-[2-[4-ethoxy-3-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl]-methyl-ammonium CAS Name: cyclohexylmethyl-[2-[4-ethoxy-3-(1-piperidinylsulfonyl)anilino]-2-oxoethyl]-methylammonium IUPAC Name: cyclohexylmethyl-[2-(4-ethoxy-3-piperidin-1-ylsulfonylanilino)-2-oxoethyl]-methylazanium Traditional Name: cyclohexylmethyl-[2-(4-ethoxy-3-piperidinosulfonyl-anilino)-2-keto-ethyl]-methyl-ammonium Formula: C23H38N3O4S+ MolecularWeight: 452.63052

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C[NH+](C)CC2CCCCC2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C[NH+](C)CC2CCCCC2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C23H37N3O4S/c1-3-30-21-13-12-20(16-22(21)31(28,29)26-14-8-5-9-15-26)24-23(27)18-25(2)17-19-10-6-4-7-11-19/h12-13,16,19H,3-11,14-15,17-18H2,1-2H3,(H,24,27)/p+1