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

Systemtic Name: 3-(3H-1,3-benzoxazol-2-ylidene)-4-(3-methoxy-5-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)butanoic acid Openeye Name: 3-(3H-1,3-benzoxazol-2-ylidene)-4-(3-methoxy-5-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)butanoic acid CAS Name: 3-(3H-1,3-benzoxazol-2-ylidene)-4-(3-methoxy-5-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)butanoic acid IUPAC Name: 3-(3H-1,3-benzoxazol-2-ylidene)-4-(3-methoxy-5-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)butanoic acid Traditional Name: 3-(3H-1,3-benzoxazol-2-ylidene)-4-(4-keto-3-methoxy-5-nitro-cyclohexa-2,5-dien-1-ylidene)butyric acid Formula: C18H14N2O7 MolecularWeight: 370.31296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C2NC3=CC=CC=C3O2)CC(=O)O)C=C(C1=O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C2NC3=CC=CC=C3O2)CC(=O)O)C=C(C1=O)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O7/c1-26-15-8-10(7-13(17(15)23)20(24)25)6-11(9-16(21)22)18-19-12-4-2-3-5-14(12)27-18/h2-8,19H,9H2,1H3,(H,21,22)