3-(3H-1,3-benzoxazol-2-ylidene)-4-(3-chloranyl-5-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)butanoic acid

Systemtic Name: 3-(3H-1,3-benzoxazol-2-ylidene)-4-(3-chloranyl-5-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)butanoic acid Openeye Name: 3-(3H-1,3-benzoxazol-2-ylidene)-4-(3-chloro-5-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)butanoic acid CAS Name: 3-(3H-1,3-benzoxazol-2-ylidene)-4-(3-chloro-5-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)butanoic acid IUPAC Name: 3-(3H-1,3-benzoxazol-2-ylidene)-4-(3-chloro-5-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)butanoic acid Traditional Name: 3-(3H-1,3-benzoxazol-2-ylidene)-4-(3-chloro-5-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)butyric acid Formula: C17H12ClNO5 MolecularWeight: 345.73388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C(CC(=O)O)C=C3C=C(C(=O)C(=C3)Cl)O)O2

Isomeric SMILES

C1=CC=C2C(=C1)NC(=C(CC(=O)O)C=C3C=C(C(=O)C(=C3)Cl)O)O2

InChI

InChI=1S/C17H12ClNO5/c18-11-6-9(7-13(20)16(11)23)5-10(8-15(21)22)17-19-12-3-1-2-4-14(12)24-17/h1-7,19-20H,8H2,(H,21,22)