3-[(4-methoxyphenyl)methyl]-5-nitro-benzoic acid

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-5-nitro-benzoic acid Openeye Name: 3-[(4-methoxyphenyl)methyl]-5-nitro-benzoic acid CAS Name: 3-[(4-methoxyphenyl)methyl]-5-nitrobenzoic acid IUPAC Name: 3-[(4-methoxyphenyl)methyl]-5-nitrobenzoic acid Traditional Name: 3-nitro-5-p-anisyl-benzoic acid Formula: C15H13NO5 MolecularWeight: 287.26742

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=CC(=CC(=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CC2=CC(=CC(=C2)C(=O)O)[N+](=O)[O-]

InChI

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