methyl 3-[(5-nitropyridin-2-yl)-phenyl-amino]propanoate

Systemtic Name: methyl 3-[(5-nitropyridin-2-yl)-phenyl-amino]propanoate Openeye Name: methyl 3-(N-(5-nitro-2-pyridyl)anilino)propanoate CAS Name: 3-(N-(5-nitro-2-pyridinyl)anilino)propanoic acid methyl ester IUPAC Name: methyl 3-(N-(5-nitropyridin-2-yl)anilino)propanoate Traditional Name: 3-(N-(5-nitro-2-pyridyl)anilino)propionic acid methyl ester Formula: C15H15N3O4 MolecularWeight: 301.2973

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN(C1=CC=CC=C1)C2=NC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCN(C1=CC=CC=C1)C2=NC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H15N3O4/c1-22-15(19)9-10-17(12-5-3-2-4-6-12)14-8-7-13(11-16-14)18(20)21/h2-8,11H,9-10H2,1H3