(E)-2-[azanyl(4-methylpentanoyl)amino]-3-cyclohexyl-2-methyl-N-oxidanyl-5-phenyl-pent-4-enamide; 4-methylbenzenesulfonic acid

Systemtic Name: (E)-2-[azanyl(4-methylpentanoyl)amino]-3-cyclohexyl-2-methyl-N-oxidanyl-5-phenyl-pent-4-enamide; 4-methylbenzenesulfonic acid Openeye Name: (E)-2-[amino(4-methylpentanoyl)amino]-3-cyclohexyl-2-methyl-5-phenyl-pent-4-enehydroxamic acid; 4-methylbenzenesulfonic acid CAS Name: (E)-2-[amino-(4-methyl-1-oxopentyl)amino]-3-cyclohexyl-N-hydroxy-2-methyl-5-phenyl-4-pentenamide; 4-methylbenzenesulfonic acid IUPAC Name: (E)-2-[amino(4-methylpentanoyl)amino]-3-cyclohexyl-N-hydroxy-2-methyl-5-phenylpent-4-enamide; 4-methylbenzenesulfonic acid Traditional Name: (E)-2-[amino(4-methylpentanoyl)amino]-3-cyclohexyl-2-methyl-5-phenyl-pent-4-enehydroxamic acid; tosylic acid Formula: C31H45N3O6S MolecularWeight: 587.7705

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CC(C)CCC(=O)N(C(C)(C(C=CC1=CC=CC=C1)C2CCCCC2)C(=O)NO)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CC(C)CCC(=O)N(C(C)(C(/C=C/C1=CC=CC=C1)C2CCCCC2)C(=O)NO)N

InChI

InChI=1S/C24H37N3O3.C7H8O3S/c1-18(2)14-17-22(28)27(25)24(3,23(29)26-30)21(20-12-8-5-9-13-20)16-15-19-10-6-4-7-11-19;1-6-2-4-7(5-3-6)11(8,9)10/h4,6-7,10-11,15-16,18,20-21,30H,5,8-9,12-14,17,25H2,1-3H3,(H,26,29);2-5H,1H3,(H,8,9,10)/b16-15+;