N-[(E)-[4-tert-butyl-2-(phenylmethyl)cyclohexylidene]amino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-[4-tert-butyl-2-(phenylmethyl)cyclohexylidene]amino]-2,4-dinitro-aniline Openeye Name: N-[(E)-(2-benzyl-4-tert-butyl-cyclohexylidene)amino]-2,4-dinitro-aniline CAS Name: N-[(E)-[4-tert-butyl-2-(phenylmethyl)cyclohexylidene]amino]-2,4-dinitroaniline IUPAC Name: N-[(E)-(2-benzyl-4-tert-butylcyclohexylidene)amino]-2,4-dinitroaniline Traditional Name: [(E)-(2-benzyl-4-tert-butyl-cyclohexylidene)amino]-(2,4-dinitrophenyl)amine Formula: C23H28N4O4 MolecularWeight: 424.49282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C(C1)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1CC/C(=N\NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])/C(C1)CC3=CC=CC=C3

InChI

InChI=1S/C23H28N4O4/c1-23(2,3)18-9-11-20(17(14-18)13-16-7-5-4-6-8-16)24-25-21-12-10-19(26(28)29)15-22(21)27(30)31/h4-8,10,12,15,17-18,25H,9,11,13-14H2,1-3H3/b24-20+