4-[(2-methylphenyl)methoxy]-3-nitro-benzoic acid

Systemtic Name: 4-[(2-methylphenyl)methoxy]-3-nitro-benzoic acid Openeye Name: 3-nitro-4-(o-tolylmethoxy)benzoic acid CAS Name: 4-[(2-methylphenyl)methoxy]-3-nitrobenzoic acid IUPAC Name: 4-[(2-methylphenyl)methoxy]-3-nitrobenzoic acid Traditional Name: 4-(2-methylbenzyl)oxy-3-nitro-benzoic acid Formula: C15H13NO5 MolecularWeight: 287.26742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1COC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C15H13NO5/c1-10-4-2-3-5-12(10)9-21-14-7-6-11(15(17)18)8-13(14)16(19)20/h2-8H,9H2,1H3,(H,17,18)