[4-(4-nitrophenyl)-2-piperazin-1-yl-quinolin-3-yl] hydrogen carbonate

Systemtic Name: [4-(4-nitrophenyl)-2-piperazin-1-yl-quinolin-3-yl] hydrogen carbonate Openeye Name: [4-(4-nitrophenyl)-2-piperazin-1-yl-3-quinolyl] hydrogen carbonate CAS Name: carbonic acid [4-(4-nitrophenyl)-2-(1-piperazinyl)-3-quinolinyl] ester IUPAC Name: [4-(4-nitrophenyl)-2-piperazin-1-ylquinolin-3-yl] hydrogen carbonate Traditional Name: carbonic acid [4-(4-nitrophenyl)-2-piperazino-3-quinolyl] ester Formula: C20H18N4O5 MolecularWeight: 394.38072

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC3=CC=CC=C3C(=C2OC(=O)O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)C2=NC3=CC=CC=C3C(=C2OC(=O)O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O5/c25-20(26)29-18-17(13-5-7-14(8-6-13)24(27)28)15-3-1-2-4-16(15)22-19(18)23-11-9-21-10-12-23/h1-8,21H,9-12H2,(H,25,26)