4-[2-methoxy-4-[(E)-3-morpholin-4-yl-3-oxidanylidene-prop-1-enyl]phenyl]benzoic acid

Systemtic Name: 4-[2-methoxy-4-[(E)-3-morpholin-4-yl-3-oxidanylidene-prop-1-enyl]phenyl]benzoic acid Openeye Name: 4-[2-methoxy-4-[(E)-3-morpholino-3-oxo-prop-1-enyl]phenyl]benzoic acid CAS Name: 4-[2-methoxy-4-[(E)-3-(4-morpholinyl)-3-oxoprop-1-enyl]phenyl]benzoic acid IUPAC Name: 4-[2-methoxy-4-[(E)-3-morpholin-4-yl-3-oxoprop-1-enyl]phenyl]benzoic acid Traditional Name: 4-[4-[(E)-3-keto-3-morpholino-prop-1-enyl]-2-methoxy-phenyl]benzoic acid Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)N2CCOCC2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)N2CCOCC2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C21H21NO5/c1-26-19-14-15(3-9-20(23)22-10-12-27-13-11-22)2-8-18(19)16-4-6-17(7-5-16)21(24)25/h2-9,14H,10-13H2,1H3,(H,24,25)/b9-3+