(E)-3-[3-cyclohexyl-5-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-4-phenyl-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-cyclohexyl-5-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-4-phenyl-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-cyclohexyl-5-(2-morpholino-2-oxo-ethyl)-4-phenyl-phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-cyclohexyl-5-[2-(4-morpholinyl)-2-oxoethyl]-4-phenylphenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-cyclohexyl-5-(2-morpholin-4-yl-2-oxoethyl)-4-phenylphenyl]prop-2-enoic acid Traditional Name: (E)-3-[3-cyclohexyl-5-(2-keto-2-morpholino-ethyl)-4-phenyl-phenyl]acrylic acid Formula: C27H31NO4 MolecularWeight: 433.53934

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(C(=CC(=C2)C=CC(=O)O)CC(=O)N3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)C2=C(C(=CC(=C2)/C=C/C(=O)O)CC(=O)N3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C27H31NO4/c29-25(28-13-15-32-16-14-28)19-23-17-20(11-12-26(30)31)18-24(21-7-3-1-4-8-21)27(23)22-9-5-2-6-10-22/h2,5-6,9-12,17-18,21H,1,3-4,7-8,13-16,19H2,(H,30,31)/b12-11+