4-(2-decylphenyl)-4-(4-nitrophenyl)carbonyloxy-cyclohexa-2,5-diene-1-carboxylic acid

Systemtic Name: 4-(2-decylphenyl)-4-(4-nitrophenyl)carbonyloxy-cyclohexa-2,5-diene-1-carboxylic acid Openeye Name: 4-(2-decylphenyl)-4-(4-nitrobenzoyl)oxy-cyclohexa-2,5-diene-1-carboxylic acid CAS Name: 4-(2-decylphenyl)-4-[(4-nitrophenyl)-oxomethoxy]-1-cyclohexa-2,5-dienecarboxylic acid IUPAC Name: 4-(2-decylphenyl)-4-(4-nitrobenzoyl)oxycyclohexa-2,5-diene-1-carboxylic acid Traditional Name: 4-(2-decylphenyl)-4-(4-nitrobenzoyl)oxy-cyclohexa-2,5-diene-1-carboxylic acid Formula: C30H35NO6 MolecularWeight: 505.602

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC=CC=C1C2(C=CC(C=C2)C(=O)O)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCC1=CC=CC=C1C2(C=CC(C=C2)C(=O)O)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C30H35NO6/c1-2-3-4-5-6-7-8-9-12-23-13-10-11-14-27(23)30(21-19-24(20-22-30)28(32)33)37-29(34)25-15-17-26(18-16-25)31(35)36/h10-11,13-22,24H,2-9,12H2,1H3,(H,32,33)