dimethyl 4-methyl-2-(2-nitrophenyl)-6-piperidin-1-yl-benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 4-methyl-2-(2-nitrophenyl)-6-piperidin-1-yl-benzene-1,3-dicarboxylate Openeye Name: dimethyl 4-methyl-2-(2-nitrophenyl)-6-(1-piperidyl)benzene-1,3-dicarboxylate CAS Name: 4-methyl-2-(2-nitrophenyl)-6-(1-piperidinyl)benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-methyl-2-(2-nitrophenyl)-6-piperidin-1-ylbenzene-1,3-dicarboxylate Traditional Name: 4-methyl-2-(2-nitrophenyl)-6-piperidino-benzene-1,3-dicarboxylic acid dimethyl ester Formula: C22H24N2O6 MolecularWeight: 412.43576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C(=O)OC)C2=CC=CC=C2[N+](=O)[O-])C(=O)OC)N3CCCCC3

Isomeric SMILES

CC1=CC(=C(C(=C1C(=O)OC)C2=CC=CC=C2[N+](=O)[O-])C(=O)OC)N3CCCCC3

InChI

InChI=1S/C22H24N2O6/c1-14-13-17(23-11-7-4-8-12-23)20(22(26)30-3)19(18(14)21(25)29-2)15-9-5-6-10-16(15)24(27)28/h5-6,9-10,13H,4,7-8,11-12H2,1-3H3