4-[(3-cyclohexyl-1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]-3-[3-(4-methyl-2-oxidanyl-phenyl)propylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3-cyclohexyl-1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]-3-[3-(4-methyl-2-oxidanyl-phenyl)propylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[1-(cyclohexylmethyl)-2-hydroxy-2-oxo-ethyl]amino]-3-[3-(2-hydroxy-4-methyl-phenyl)propylamino]-4-oxo-butanoic acid CAS Name: 4-[(3-cyclohexyl-1-hydroxy-1-oxopropan-2-yl)amino]-3-[3-(2-hydroxy-4-methylphenyl)propylamino]-4-oxobutanoic acid IUPAC Name: 4-[(3-cyclohexyl-1-hydroxy-1-oxopropan-2-yl)amino]-3-[3-(2-hydroxy-4-methylphenyl)propylamino]-4-oxobutanoic acid Traditional Name: 4-[[1-(cyclohexylmethyl)-2-hydroxy-2-keto-ethyl]amino]-3-[3-(2-hydroxy-4-methyl-phenyl)propylamino]-4-keto-butyric acid Formula: C23H34N2O6 MolecularWeight: 434.52586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CCCNC(CC(=O)O)C(=O)NC(CC2CCCCC2)C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1)CCCNC(CC(=O)O)C(=O)NC(CC2CCCCC2)C(=O)O)O

InChI

InChI=1S/C23H34N2O6/c1-15-9-10-17(20(26)12-15)8-5-11-24-18(14-21(27)28)22(29)25-19(23(30)31)13-16-6-3-2-4-7-16/h9-10,12,16,18-19,24,26H,2-8,11,13-14H2,1H3,(H,25,29)(H,27,28)(H,30,31)