ethyl 2-[6-(4-methylpiperazin-1-yl)-3-nitro-pyridin-2-yl]benzoate

Systemtic Name: ethyl 2-[6-(4-methylpiperazin-1-yl)-3-nitro-pyridin-2-yl]benzoate Openeye Name: ethyl 2-[6-(4-methylpiperazin-1-yl)-3-nitro-2-pyridyl]benzoate CAS Name: 2-[6-(4-methyl-1-piperazinyl)-3-nitro-2-pyridinyl]benzoic acid ethyl ester IUPAC Name: ethyl 2-[6-(4-methylpiperazin-1-yl)-3-nitropyridin-2-yl]benzoate Traditional Name: 2-[6-(4-methylpiperazino)-3-nitro-2-pyridyl]benzoic acid ethyl ester Formula: C19H22N4O4 MolecularWeight: 370.40238

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1C2=C(C=CC(=N2)N3CCN(CC3)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1C2=C(C=CC(=N2)N3CCN(CC3)C)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O4/c1-3-27-19(24)15-7-5-4-6-14(15)18-16(23(25)26)8-9-17(20-18)22-12-10-21(2)11-13-22/h4-9H,3,10-13H2,1-2H3