4-[(2-benzo[e][1,3]benzoxazol-2-ylphenyl)amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: 4-[(2-benzo[e][1,3]benzoxazol-2-ylphenyl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: 4-(2-benzo[e][1,3]benzoxazol-2-ylanilino)-4-oxo-but-2-enoic acid CAS Name: 4-[2-(2-benzo[e][1,3]benzoxazolyl)anilino]-4-oxo-2-butenoic acid IUPAC Name: 4-(2-benzo[e][1,3]benzoxazol-2-ylanilino)-4-oxobut-2-enoic acid Traditional Name: 4-(2-benzo[e][1,3]benzoxazol-2-ylanilino)-4-keto-but-2-enoic acid Formula: C21H14N2O4 MolecularWeight: 358.34686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2N=C(O3)C4=CC=CC=C4NC(=O)C=CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2N=C(O3)C4=CC=CC=C4NC(=O)C=CC(=O)O

InChI

InChI=1S/C21H14N2O4/c24-18(11-12-19(25)26)22-16-8-4-3-7-15(16)21-23-20-14-6-2-1-5-13(14)9-10-17(20)27-21/h1-12H,(H,22,24)(H,25,26)