6-[[3-methoxy-4-(2-phenylethanoylamino)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[[3-methoxy-4-(2-phenylethanoylamino)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[[3-methoxy-4-[(2-phenylacetyl)amino]phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[[3-methoxy-4-[(1-oxo-2-phenylethyl)amino]anilino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[[3-methoxy-4-[(2-phenylacetyl)amino]phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[[3-methoxy-4-[(2-phenylacetyl)amino]phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C23H24N2O5 MolecularWeight: 408.44706

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)C2CC=CCC2C(=O)O)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)C2CC=CCC2C(=O)O)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C23H24N2O5/c1-30-20-14-16(24-22(27)17-9-5-6-10-18(17)23(28)29)11-12-19(20)25-21(26)13-15-7-3-2-4-8-15/h2-8,11-12,14,17-18H,9-10,13H2,1H3,(H,24,27)(H,25,26)(H,28,29)