5-[(E)-4-(diethylamino)-4-oxidanylidene-but-2-en-2-yl]-2-(1-phenylethoxy)benzoic acid

Systemtic Name: 5-[(E)-4-(diethylamino)-4-oxidanylidene-but-2-en-2-yl]-2-(1-phenylethoxy)benzoic acid Openeye Name: 5-[(E)-3-(diethylamino)-1-methyl-3-oxo-prop-1-enyl]-2-(1-phenylethoxy)benzoic acid CAS Name: 5-[(E)-4-(diethylamino)-4-oxobut-2-en-2-yl]-2-(1-phenylethoxy)benzoic acid IUPAC Name: 5-[(E)-4-(diethylamino)-4-oxobut-2-en-2-yl]-2-(1-phenylethoxy)benzoic acid Traditional Name: 5-[(E)-3-(diethylamino)-3-keto-1-methyl-prop-1-enyl]-2-(1-phenylethoxy)benzoic acid Formula: C23H27NO4 MolecularWeight: 381.46478

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C=C(C)C1=CC(=C(C=C1)OC(C)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCN(CC)C(=O)/C=C(\C)/C1=CC(=C(C=C1)OC(C)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C23H27NO4/c1-5-24(6-2)22(25)14-16(3)19-12-13-21(20(15-19)23(26)27)28-17(4)18-10-8-7-9-11-18/h7-15,17H,5-6H2,1-4H3,(H,26,27)/b16-14+