[2-[(4-methylphenyl)sulfonylmethyl]-4-(propan-2-ylamino)cyclohexyl]carbamic acid

Systemtic Name: [2-[(4-methylphenyl)sulfonylmethyl]-4-(propan-2-ylamino)cyclohexyl]carbamic acid Openeye Name: [4-(isopropylamino)-2-(p-tolylsulfonylmethyl)cyclohexyl]carbamic acid CAS Name: [2-[(4-methylphenyl)sulfonylmethyl]-4-(propan-2-ylamino)cyclohexyl]carbamic acid IUPAC Name: [2-[(4-methylphenyl)sulfonylmethyl]-4-(propan-2-ylamino)cyclohexyl]carbamic acid Traditional Name: [4-(isopropylamino)-2-(tosylmethyl)cyclohexyl]carbamic acid Formula: C18H28N2O4S MolecularWeight: 368.49092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2CC(CCC2NC(=O)O)NC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2CC(CCC2NC(=O)O)NC(C)C

InChI

InChI=1S/C18H28N2O4S/c1-12(2)19-15-6-9-17(20-18(21)22)14(10-15)11-25(23,24)16-7-4-13(3)5-8-16/h4-5,7-8,12,14-15,17,19-20H,6,9-11H2,1-3H3,(H,21,22)