N-(4-ethylhexyl)-5-nitro-2-[(E)-2-phenylethenyl]aniline

Systemtic Name: N-(4-ethylhexyl)-5-nitro-2-[(E)-2-phenylethenyl]aniline Openeye Name: N-(4-ethylhexyl)-5-nitro-2-[(E)-styryl]aniline CAS Name: N-(4-ethylhexyl)-5-nitro-2-[(E)-2-phenylethenyl]aniline IUPAC Name: N-(4-ethylhexyl)-5-nitro-2-[(E)-2-phenylethenyl]aniline Traditional Name: 4-ethylhexyl-[5-nitro-2-[(E)-styryl]phenyl]amine Formula: C22H28N2O2 MolecularWeight: 352.46992

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CCCNC1=C(C=CC(=C1)[N+](=O)[O-])C=CC2=CC=CC=C2

Isomeric SMILES

CCC(CC)CCCNC1=C(C=CC(=C1)[N+](=O)[O-])/C=C/C2=CC=CC=C2

InChI

InChI=1S/C22H28N2O2/c1-3-18(4-2)11-8-16-23-22-17-21(24(25)26)15-14-20(22)13-12-19-9-6-5-7-10-19/h5-7,9-10,12-15,17-18,23H,3-4,8,11,16H2,1-2H3/b13-12+