N-[(Z)-(6,6-dimethyl-2-phenyl-5,7-dihydrobenzotriazol-4-ylidene)amino]-4-nitro-aniline

Systemtic Name: N-[(Z)-(6,6-dimethyl-2-phenyl-5,7-dihydrobenzotriazol-4-ylidene)amino]-4-nitro-aniline Openeye Name: N-[(Z)-(6,6-dimethyl-2-phenyl-5,7-dihydrobenzotriazol-4-ylidene)amino]-4-nitro-aniline CAS Name: N-[(Z)-(6,6-dimethyl-2-phenyl-5,7-dihydrobenzotriazol-4-ylidene)amino]-4-nitroaniline IUPAC Name: N-[(Z)-(6,6-dimethyl-2-phenyl-5,7-dihydrobenzotriazol-4-ylidene)amino]-4-nitroaniline Traditional Name: [(Z)-(6,6-dimethyl-2-phenyl-5,7-dihydrobenzotriazol-4-ylidene)amino]-(4-nitrophenyl)amine Formula: C20H20N6O2 MolecularWeight: 376.4118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=NN(N=C2C(=NNC3=CC=C(C=C3)[N+](=O)[O-])C1)C4=CC=CC=C4)C

Isomeric SMILES

CC1(CC2=NN(N=C2/C(=N\NC3=CC=C(C=C3)[N+](=O)[O-])/C1)C4=CC=CC=C4)C

InChI

InChI=1S/C20H20N6O2/c1-20(2)12-17(22-21-14-8-10-16(11-9-14)26(27)28)19-18(13-20)23-25(24-19)15-6-4-3-5-7-15/h3-11,21H,12-13H2,1-2H3/b22-17-