6-[[3-[(3-chloranyl-4-methyl-phenyl)carbamoyl]-4-morpholin-4-yl-phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[[3-[(3-chloranyl-4-methyl-phenyl)carbamoyl]-4-morpholin-4-yl-phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[[3-[(3-chloro-4-methyl-phenyl)carbamoyl]-4-morpholino-phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[[3-[(3-chloro-4-methylanilino)-oxomethyl]-4-(4-morpholinyl)anilino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[[3-[(3-chloro-4-methylphenyl)carbamoyl]-4-morpholin-4-ylphenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[[3-[(3-chloro-4-methyl-phenyl)carbamoyl]-4-morpholino-phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C26H28ClN3O5 MolecularWeight: 497.97062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)NC(=O)C3CC=CCC3C(=O)O)N4CCOCC4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)NC(=O)C3CC=CCC3C(=O)O)N4CCOCC4)Cl

InChI

InChI=1S/C26H28ClN3O5/c1-16-6-7-18(15-22(16)27)29-25(32)21-14-17(8-9-23(21)30-10-12-35-13-11-30)28-24(31)19-4-2-3-5-20(19)26(33)34/h2-3,6-9,14-15,19-20H,4-5,10-13H2,1H3,(H,28,31)(H,29,32)(H,33,34)