[3-nitro-4-(4-pyridin-2-ylpiperazin-1-yl)phenyl]-phenyl-methanone

Systemtic Name: [3-nitro-4-(4-pyridin-2-ylpiperazin-1-yl)phenyl]-phenyl-methanone Openeye Name: [3-nitro-4-[4-(2-pyridyl)piperazin-1-yl]phenyl]-phenyl-methanone CAS Name: [3-nitro-4-[4-(2-pyridinyl)-1-piperazinyl]phenyl]-phenylmethanone IUPAC Name: [3-nitro-4-(4-pyridin-2-ylpiperazin-1-yl)phenyl]-phenylmethanone Traditional Name: [3-nitro-4-[4-(2-pyridyl)piperazino]phenyl]-phenyl-methanone Formula: C22H20N4O3 MolecularWeight: 388.4192

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)[N+](=O)[O-])C4=CC=CC=N4

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)[N+](=O)[O-])C4=CC=CC=N4

InChI

InChI=1S/C22H20N4O3/c27-22(17-6-2-1-3-7-17)18-9-10-19(20(16-18)26(28)29)24-12-14-25(15-13-24)21-8-4-5-11-23-21/h1-11,16H,12-15H2