ethyl 4-methyl-2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]quinoline-3-carboxylate

Systemtic Name: ethyl 4-methyl-2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]quinoline-3-carboxylate Openeye Name: ethyl 4-methyl-2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]quinoline-3-carboxylate CAS Name: 4-methyl-2-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]quinoline-3-carboxylate Traditional Name: 4-methyl-2-[[4-(4-nitrophenyl)piperazino]methyl]quinoline-3-carboxylic acid ethyl ester Formula: C24H26N4O4 MolecularWeight: 434.48764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1CN3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1CN3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C24H26N4O4/c1-3-32-24(29)23-17(2)20-6-4-5-7-21(20)25-22(23)16-26-12-14-27(15-13-26)18-8-10-19(11-9-18)28(30)31/h4-11H,3,12-16H2,1-2H3