2-[2-[(5-methylpyridin-2-yl)iminomethyl]-4-nitro-phenoxy]carbonylbenzoic acid

Systemtic Name: 2-[2-[(5-methylpyridin-2-yl)iminomethyl]-4-nitro-phenoxy]carbonylbenzoic acid Openeye Name: 2-[2-[(5-methyl-2-pyridyl)iminomethyl]-4-nitro-phenoxy]carbonylbenzoic acid CAS Name: 2-[[2-[(5-methyl-2-pyridinyl)iminomethyl]-4-nitrophenoxy]-oxomethyl]benzoic acid IUPAC Name: 2-[2-[(5-methylpyridin-2-yl)iminomethyl]-4-nitrophenoxy]carbonylbenzoic acid Traditional Name: 2-[2-[(5-methyl-2-pyridyl)iminomethyl]-4-nitro-phenoxy]carbonylbenzoic acid Formula: C21H15N3O6 MolecularWeight: 405.3603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)N=CC2=C(C=CC(=C2)[N+](=O)[O-])OC(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

CC1=CN=C(C=C1)N=CC2=C(C=CC(=C2)[N+](=O)[O-])OC(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C21H15N3O6/c1-13-6-9-19(22-11-13)23-12-14-10-15(24(28)29)7-8-18(14)30-21(27)17-5-3-2-4-16(17)20(25)26/h2-12H,1H3,(H,25,26)