methyl 4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-6-nitro-quinoline-2-carboxylate

Systemtic Name: methyl 4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-6-nitro-quinoline-2-carboxylate Openeye Name: methyl 4-(4-tert-butoxycarbonylpiperazin-1-yl)-6-nitro-quinoline-2-carboxylate CAS Name: 4-[4-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-piperazinyl]-6-nitro-2-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-6-nitroquinoline-2-carboxylate Traditional Name: 4-(4-tert-butoxycarbonylpiperazino)-6-nitro-quinaldic acid methyl ester Formula: C20H24N4O6 MolecularWeight: 416.42776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=NC3=C2C=C(C=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=NC3=C2C=C(C=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C20H24N4O6/c1-20(2,3)30-19(26)23-9-7-22(8-10-23)17-12-16(18(25)29-4)21-15-6-5-13(24(27)28)11-14(15)17/h5-6,11-12H,7-10H2,1-4H3