4-[methyl-(2-pyrrolidin-1-ylcyclohexyl)carbamoyl]benzenesulfonic acid

Systemtic Name: 4-[methyl-(2-pyrrolidin-1-ylcyclohexyl)carbamoyl]benzenesulfonic acid Openeye Name: 4-[methyl-(2-pyrrolidin-1-ylcyclohexyl)carbamoyl]benzenesulfonic acid CAS Name: 4-[[methyl-[2-(1-pyrrolidinyl)cyclohexyl]amino]-oxomethyl]benzenesulfonic acid IUPAC Name: 4-[methyl-(2-pyrrolidin-1-ylcyclohexyl)carbamoyl]benzenesulfonic acid Traditional Name: 4-[methyl-(2-pyrrolidinocyclohexyl)carbamoyl]besylic acid Formula: C18H26N2O4S MolecularWeight: 366.47504

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1N2CCCC2)C(=O)C3=CC=C(C=C3)S(=O)(=O)O

Isomeric SMILES

CN(C1CCCCC1N2CCCC2)C(=O)C3=CC=C(C=C3)S(=O)(=O)O

InChI

InChI=1S/C18H26N2O4S/c1-19(16-6-2-3-7-17(16)20-12-4-5-13-20)18(21)14-8-10-15(11-9-14)25(22,23)24/h8-11,16-17H,2-7,12-13H2,1H3,(H,22,23,24)