(E)-4-[[2-(cyclohexylcarbamoyl)phenyl]-methyl-amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[2-(cyclohexylcarbamoyl)phenyl]-methyl-amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[2-(cyclohexylcarbamoyl)-N-methyl-anilino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[2-[(cyclohexylamino)-oxomethyl]-N-methylanilino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[2-(cyclohexylcarbamoyl)-N-methylanilino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[2-(cyclohexylcarbamoyl)-N-methyl-anilino]-4-keto-but-2-enoic acid Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)NC2CCCCC2)C(=O)C=CC(=O)O

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)NC2CCCCC2)C(=O)/C=C/C(=O)O

InChI

InChI=1S/C18H22N2O4/c1-20(16(21)11-12-17(22)23)15-10-6-5-9-14(15)18(24)19-13-7-3-2-4-8-13/h5-6,9-13H,2-4,7-8H2,1H3,(H,19,24)(H,22,23)/b12-11+