6,7-dimethyl-3-[4-(4-nitrophenyl)piperazin-1-yl]quinoxaline-2-carbonitrile

Systemtic Name: 6,7-dimethyl-3-[4-(4-nitrophenyl)piperazin-1-yl]quinoxaline-2-carbonitrile Openeye Name: 6,7-dimethyl-3-[4-(4-nitrophenyl)piperazin-1-yl]quinoxaline-2-carbonitrile CAS Name: 6,7-dimethyl-3-[4-(4-nitrophenyl)-1-piperazinyl]-2-quinoxalinecarbonitrile IUPAC Name: 6,7-dimethyl-3-[4-(4-nitrophenyl)piperazin-1-yl]quinoxaline-2-carbonitrile Traditional Name: 6,7-dimethyl-3-[4-(4-nitrophenyl)piperazino]quinoxaline-2-carbonitrile Formula: C21H20N6O2 MolecularWeight: 388.4225

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(N=C2C=C1C)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=CC2=NC(=C(N=C2C=C1C)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])C#N

InChI

InChI=1S/C21H20N6O2/c1-14-11-18-19(12-15(14)2)24-21(20(13-22)23-18)26-9-7-25(8-10-26)16-3-5-17(6-4-16)27(28)29/h3-6,11-12H,7-10H2,1-2H3