N-methyl-8-nitro-6-phenyl-4H-pyrazolo[1,5-a][1,4]benzodiazepin-2-amine

Systemtic Name: N-methyl-8-nitro-6-phenyl-4H-pyrazolo[1,5-a][1,4]benzodiazepin-2-amine Openeye Name: N-methyl-8-nitro-6-phenyl-4H-pyrazolo[1,5-a][1,4]benzodiazepin-2-amine CAS Name: N-methyl-8-nitro-6-phenyl-4H-pyrazolo[1,5-a][1,4]benzodiazepin-2-amine IUPAC Name: N-methyl-8-nitro-6-phenyl-4H-pyrazolo[1,5-a][1,4]benzodiazepin-2-amine Traditional Name: methyl-(8-nitro-6-phenyl-4H-pyrazolo[1,5-a][1,4]benzodiazepin-2-yl)amine Formula: C18H15N5O2 MolecularWeight: 333.344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=NN2C(=C1)CN=C(C3=C2C=CC(=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CNC1=NN2C(=C1)CN=C(C3=C2C=CC(=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C18H15N5O2/c1-19-17-10-14-11-20-18(12-5-3-2-4-6-12)15-9-13(23(24)25)7-8-16(15)22(14)21-17/h2-10H,11H2,1H3,(H,19,21)