[2-methoxy-5-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]phenyl] N-methylcarbamate

Systemtic Name: [2-methoxy-5-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]phenyl] N-methylcarbamate Openeye Name: [2-methoxy-5-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]phenyl] N-methylcarbamate CAS Name: N-methylcarbamic acid [2-methoxy-5-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]phenyl] ester IUPAC Name: [2-methoxy-5-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]phenyl] N-methylcarbamate Traditional Name: N-methylcarbamic acid [2-methoxy-5-[[4-(4-nitrophenyl)piperazino]methyl]phenyl] ester Formula: C20H24N4O5 MolecularWeight: 400.42836

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)OC1=C(C=CC(=C1)CN2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CNC(=O)OC1=C(C=CC(=C1)CN2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C20H24N4O5/c1-21-20(25)29-19-13-15(3-8-18(19)28-2)14-22-9-11-23(12-10-22)16-4-6-17(7-5-16)24(26)27/h3-8,13H,9-12,14H2,1-2H3,(H,21,25)