2-(1,3-benzoxazol-2-yl)-5-ethenyl-3-(2-oxidanylideneethyl)-4-phenylazanyl-benzoic acid

Systemtic Name: 2-(1,3-benzoxazol-2-yl)-5-ethenyl-3-(2-oxidanylideneethyl)-4-phenylazanyl-benzoic acid Openeye Name: 4-anilino-2-(1,3-benzoxazol-2-yl)-3-(2-oxoethyl)-5-vinyl-benzoic acid CAS Name: 4-anilino-2-(1,3-benzoxazol-2-yl)-5-ethenyl-3-(2-oxoethyl)benzoic acid IUPAC Name: 4-anilino-2-(1,3-benzoxazol-2-yl)-5-ethenyl-3-(2-oxoethyl)benzoic acid Traditional Name: 4-anilino-2-(1,3-benzoxazol-2-yl)-3-(2-ketoethyl)-5-vinyl-benzoic acid Formula: C24H18N2O4 MolecularWeight: 398.41072

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=C(C(=C(C(=C1)C(=O)O)C2=NC3=CC=CC=C3O2)CC=O)NC4=CC=CC=C4

Isomeric SMILES

C=CC1=C(C(=C(C(=C1)C(=O)O)C2=NC3=CC=CC=C3O2)CC=O)NC4=CC=CC=C4

InChI

InChI=1S/C24H18N2O4/c1-2-15-14-18(24(28)29)21(23-26-19-10-6-7-11-20(19)30-23)17(12-13-27)22(15)25-16-8-4-3-5-9-16/h2-11,13-14,25H,1,12H2,(H,28,29)