[2-[(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-(diphenylmethyl)-methyl-azanium

Systemtic Name: [2-[(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-(diphenylmethyl)-methyl-azanium Openeye Name: benzhydryl-[2-(2-chloro-5-pyrrolidin-1-ylsulfonyl-anilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-[2-chloro-5-(1-pyrrolidinylsulfonyl)anilino]-2-oxoethyl]-(diphenylmethyl)-methylammonium IUPAC Name: benzhydryl-[2-(2-chloro-5-pyrrolidin-1-ylsulfonylanilino)-2-oxoethyl]-methylazanium Traditional Name: benzhydryl-[2-(2-chloro-5-pyrrolidinosulfonyl-anilino)-2-keto-ethyl]-methyl-ammonium Formula: C26H29ClN3O3S+ MolecularWeight: 499.04476

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)Cl)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C[NH+](CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)Cl)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H28ClN3O3S/c1-29(26(20-10-4-2-5-11-20)21-12-6-3-7-13-21)19-25(31)28-24-18-22(14-15-23(24)27)34(32,33)30-16-8-9-17-30/h2-7,10-15,18,26H,8-9,16-17,19H2,1H3,(H,28,31)/p+1