4-[(1E,3E)-4-(4-carboxynaphthalen-1-yl)-2,3-dinitro-buta-1,3-dienyl]naphthalene-1-carboxylic acid

Systemtic Name: 4-[(1E,3E)-4-(4-carboxynaphthalen-1-yl)-2,3-dinitro-buta-1,3-dienyl]naphthalene-1-carboxylic acid Openeye Name: 4-[(1E,3E)-4-(4-carboxy-1-naphthyl)-2,3-dinitro-buta-1,3-dienyl]naphthalene-1-carboxylic acid CAS Name: 4-[(1E,3E)-4-(4-carboxy-1-naphthalenyl)-2,3-dinitrobuta-1,3-dienyl]-1-naphthalenecarboxylic acid IUPAC Name: 4-[(1E,3E)-4-(4-carboxynaphthalen-1-yl)-2,3-dinitrobuta-1,3-dienyl]naphthalene-1-carboxylic acid Traditional Name: 4-[(1E,3E)-4-(4-carboxy-1-naphthyl)-2,3-dinitro-buta-1,3-dienyl]-1-naphthoic acid Formula: C26H16N2O8 MolecularWeight: 484.41384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=C2C(=O)O)C=C(C(=CC3=CC=C(C4=CC=CC=C34)C(=O)O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=CC=C(C2=C1)/C=C(/[N+](=O)[O-])\C(=C/C3=CC=C(C4=CC=CC=C34)C(=O)O)\[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C26H16N2O8/c29-25(30)21-11-9-15(17-5-1-3-7-19(17)21)13-23(27(33)34)24(28(35)36)14-16-10-12-22(26(31)32)20-8-4-2-6-18(16)20/h1-14H,(H,29,30)(H,31,32)/b23-13+,24-14+