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

Systemtic Name: [3-nitro-4-(4-pyrazin-2-ylpiperazin-1-yl)phenyl]-phenyl-methanone Openeye Name: [3-nitro-4-(4-pyrazin-2-ylpiperazin-1-yl)phenyl]-phenyl-methanone CAS Name: [3-nitro-4-[4-(2-pyrazinyl)-1-piperazinyl]phenyl]-phenylmethanone IUPAC Name: [3-nitro-4-(4-pyrazin-2-ylpiperazin-1-yl)phenyl]-phenylmethanone Traditional Name: [3-nitro-4-(4-pyrazin-2-ylpiperazino)phenyl]-phenyl-methanone Formula: C21H19N5O3 MolecularWeight: 389.40726

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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=NC=CN=C4

Isomeric SMILES

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

InChI

InChI=1S/C21H19N5O3/c27-21(16-4-2-1-3-5-16)17-6-7-18(19(14-17)26(28)29)24-10-12-25(13-11-24)20-15-22-8-9-23-20/h1-9,14-15H,10-13H2