methyl 2-[[1-(2-hydroxyethyl)-4,5,6,7-tetrahydroindazol-4-yl]amino]-5-nitro-benzoate

Systemtic Name: methyl 2-[[1-(2-hydroxyethyl)-4,5,6,7-tetrahydroindazol-4-yl]amino]-5-nitro-benzoate Openeye Name: methyl 2-[[1-(2-hydroxyethyl)-4,5,6,7-tetrahydroindazol-4-yl]amino]-5-nitro-benzoate CAS Name: 2-[[1-(2-hydroxyethyl)-4,5,6,7-tetrahydroindazol-4-yl]amino]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-[[1-(2-hydroxyethyl)-4,5,6,7-tetrahydroindazol-4-yl]amino]-5-nitrobenzoate Traditional Name: 2-[[1-(2-hydroxyethyl)-4,5,6,7-tetrahydroindazol-4-yl]amino]-5-nitro-benzoic acid methyl ester Formula: C17H20N4O5 MolecularWeight: 360.3645

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NC2CCCC3=C2C=NN3CCO

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NC2CCCC3=C2C=NN3CCO

InChI

InChI=1S/C17H20N4O5/c1-26-17(23)12-9-11(21(24)25)5-6-15(12)19-14-3-2-4-16-13(14)10-18-20(16)7-8-22/h5-6,9-10,14,19,22H,2-4,7-8H2,1H3