N-[(E)-[(E)-3-(4-bromophenyl)-1-(2,4,6-trimethylphenyl)prop-2-enylidene]amino]-2,4-dinitro-aniline hydrochloride

Systemtic Name: N-[(E)-[(E)-3-(4-bromophenyl)-1-(2,4,6-trimethylphenyl)prop-2-enylidene]amino]-2,4-dinitro-aniline hydrochloride Openeye Name: N-[(E)-[(E)-3-(4-bromophenyl)-1-(2,4,6-trimethylphenyl)prop-2-enylidene]amino]-2,4-dinitro-aniline hydrochloride CAS Name: N-[(E)-[(E)-3-(4-bromophenyl)-1-(2,4,6-trimethylphenyl)prop-2-enylidene]amino]-2,4-dinitroaniline hydrochloride IUPAC Name: N-[(E)-[(E)-3-(4-bromophenyl)-1-(2,4,6-trimethylphenyl)prop-2-enylidene]amino]-2,4-dinitroaniline hydrochloride Traditional Name: [(E)-[(E)-3-(4-bromophenyl)-1-mesityl-prop-2-enylidene]amino]-(2,4-dinitrophenyl)amine hydrochloride Formula: C24H22BrClN4O4 MolecularWeight: 545.81288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C=CC3=CC=C(C=C3)Br)C.Cl

Isomeric SMILES

CC1=CC(=C(C(=C1)C)/C(=N/NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])/C=C/C3=CC=C(C=C3)Br)C.Cl

InChI

InChI=1S/C24H21BrN4O4.ClH/c1-15-12-16(2)24(17(3)13-15)22(10-6-18-4-7-19(25)8-5-18)27-26-21-11-9-20(28(30)31)14-23(21)29(32)33;/h4-14,26H,1-3H3;1H/b10-6+,27-22+;