(E)-4-[[3-(cyclohexylcarbamoyl)phenyl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[3-(cyclohexylcarbamoyl)phenyl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[3-(cyclohexylcarbamoyl)anilino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[3-[(cyclohexylamino)-oxomethyl]anilino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[3-(cyclohexylcarbamoyl)anilino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[3-(cyclohexylcarbamoyl)anilino]-4-keto-but-2-enoic acid Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=CC(=CC=C2)NC(=O)C=CC(=O)O

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CC(=CC=C2)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C17H20N2O4/c20-15(9-10-16(21)22)18-14-8-4-5-12(11-14)17(23)19-13-6-2-1-3-7-13/h4-5,8-11,13H,1-3,6-7H2,(H,18,20)(H,19,23)(H,21,22)/b10-9+