9-methyl-3-(2-nitrophenyl)-5-piperidin-1-yl-[1,2,4]triazolo[4,3-c]quinazoline

Systemtic Name: 9-methyl-3-(2-nitrophenyl)-5-piperidin-1-yl-[1,2,4]triazolo[4,3-c]quinazoline Openeye Name: 9-methyl-3-(2-nitrophenyl)-5-(1-piperidyl)-[1,2,4]triazolo[4,3-c]quinazoline CAS Name: 9-methyl-3-(2-nitrophenyl)-5-(1-piperidinyl)-[1,2,4]triazolo[4,3-c]quinazoline IUPAC Name: 9-methyl-3-(2-nitrophenyl)-5-piperidin-1-yl-[1,2,4]triazolo[4,3-c]quinazoline Traditional Name: 9-methyl-3-(2-nitrophenyl)-5-piperidino-[1,2,4]triazolo[4,3-c]quinazoline Formula: C21H20N6O2 MolecularWeight: 388.4225

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N3C2=NN=C3C4=CC=CC=C4[N+](=O)[O-])N5CCCCC5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N3C2=NN=C3C4=CC=CC=C4[N+](=O)[O-])N5CCCCC5

InChI

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