methyl 2-(5-nitropyridin-2-yl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate

Systemtic Name: methyl 2-(5-nitropyridin-2-yl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate Openeye Name: methyl 2-(5-nitro-2-pyridyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate CAS Name: 2-(5-nitro-2-pyridinyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylic acid methyl ester IUPAC Name: methyl 2-(5-nitropyridin-2-yl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate Traditional Name: 2-(5-nitro-2-pyridyl)-1,3,4,5-tetrahydropyrid[4,3-b]indole-8-carboxylic acid methyl ester Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)NC3=C2CN(CC3)C4=NC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)NC3=C2CN(CC3)C4=NC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O4/c1-26-18(23)11-2-4-15-13(8-11)14-10-21(7-6-16(14)20-15)17-5-3-12(9-19-17)22(24)25/h2-5,8-9,20H,6-7,10H2,1H3