(3-nitrophenyl)methyl anthracene-9-carboxylate

Systemtic Name: (3-nitrophenyl)methyl anthracene-9-carboxylate Openeye Name: (3-nitrophenyl)methyl anthracene-9-carboxylate CAS Name: 9-anthracenecarboxylic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl anthracene-9-carboxylate Traditional Name: anthracene-9-carboxylic acid (3-nitrobenzyl) ester Formula: C22H15NO4 MolecularWeight: 357.3588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C(=O)OCC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C(=O)OCC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H15NO4/c24-22(27-14-15-6-5-9-18(12-15)23(25)26)21-19-10-3-1-7-16(19)13-17-8-2-4-11-20(17)21/h1-13H,14H2