1-[2-oxidanylidene-2-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[2-oxidanylidene-2-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]cyclohexane-1-carboxylic acid Openeye Name: 1-[2-oxo-2-(4-pyrrolidin-1-ylsulfonylanilino)ethyl]cyclohexanecarboxylic acid CAS Name: 1-[2-oxo-2-[4-(1-pyrrolidinylsulfonyl)anilino]ethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[2-oxo-2-(4-pyrrolidin-1-ylsulfonylanilino)ethyl]cyclohexane-1-carboxylic acid Traditional Name: 1-[2-keto-2-(4-pyrrolidinosulfonylanilino)ethyl]cyclohexanecarboxylic acid Formula: C19H26N2O5S MolecularWeight: 394.48514

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C(=O)O

Isomeric SMILES

C1CCC(CC1)(CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C(=O)O

InChI

InChI=1S/C19H26N2O5S/c22-17(14-19(18(23)24)10-2-1-3-11-19)20-15-6-8-16(9-7-15)27(25,26)21-12-4-5-13-21/h6-9H,1-5,10-14H2,(H,20,22)(H,23,24)