4-chloranyl-3-cyclohexyl-benzoic acid; (sulfinoamino)methane

Systemtic Name: 4-chloranyl-3-cyclohexyl-benzoic acid; (sulfinoamino)methane Openeye Name: 4-chloro-3-cyclohexyl-benzoic acid; (sulfinoamino)methane CAS Name: 4-chloro-3-cyclohexylbenzoic acid; (sulfinoamino)methane IUPAC Name: 4-chloro-3-cyclohexylbenzoic acid; (sulfinoamino)methane Traditional Name: 4-chloro-3-cyclohexyl-benzoic acid; (sulfinoamino)methane Formula: C14H20ClNO4S MolecularWeight: 333.8309

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)O.C1CCC(CC1)C2=C(C=CC(=C2)C(=O)O)Cl

Isomeric SMILES

CNS(=O)O.C1CCC(CC1)C2=C(C=CC(=C2)C(=O)O)Cl

InChI

InChI=1S/C13H15ClO2.CH5NO2S/c14-12-7-6-10(13(15)16)8-11(12)9-4-2-1-3-5-9;1-2-5(3)4/h6-9H,1-5H2,(H,15,16);2H,1H3,(H,3,4)