cyclopropyl-[(4-methoxyphenyl)methyl]-[2-[(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[2-[(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[2-[2-methoxy-5-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl]ammonium CAS Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[2-[2-methoxy-5-(1-piperidinylsulfonyl)anilino]-2-oxoethyl]ammonium IUPAC Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[2-(2-methoxy-5-piperidin-1-ylsulfonylanilino)-2-oxoethyl]azanium Traditional Name: cyclopropyl-[2-keto-2-(2-methoxy-5-piperidinosulfonyl-anilino)ethyl]-p-anisyl-ammonium Formula: C25H34N3O5S+ MolecularWeight: 488.61956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+](CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)OC)C4CC4

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+](CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)OC)C4CC4

InChI

InChI=1S/C25H33N3O5S/c1-32-21-10-6-19(7-11-21)17-27(20-8-9-20)18-25(29)26-23-16-22(12-13-24(23)33-2)34(30,31)28-14-4-3-5-15-28/h6-7,10-13,16,20H,3-5,8-9,14-15,17-18H2,1-2H3,(H,26,29)/p+1