2-[[7-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethanol

Systemtic Name: 2-[[7-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethanol Openeye Name: 2-[[7-[3-methyl-4-(m-tolyl)piperazin-1-yl]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethanol CAS Name: 2-[[7-[3-methyl-4-(3-methylphenyl)-1-piperazinyl]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethanol IUPAC Name: 2-[[7-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethanol Traditional Name: 2-[[7-[3-methyl-4-(m-tolyl)piperazino]-4-nitro-benzofurazan-5-yl]amino]ethanol Formula: C20H24N6O4 MolecularWeight: 412.44236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=CC(=C2)C)C3=CC(=C(C4=NON=C34)[N+](=O)[O-])NCCO

Isomeric SMILES

CC1CN(CCN1C2=CC=CC(=C2)C)C3=CC(=C(C4=NON=C34)[N+](=O)[O-])NCCO

InChI

InChI=1S/C20H24N6O4/c1-13-4-3-5-15(10-13)25-8-7-24(12-14(25)2)17-11-16(21-6-9-27)20(26(28)29)19-18(17)22-30-23-19/h3-5,10-11,14,21,27H,6-9,12H2,1-2H3