N-[(E)-[1-[(1S)-cyclohex-3-en-1-yl]-3-methyl-but-2-enylidene]amino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-[1-[(1S)-cyclohex-3-en-1-yl]-3-methyl-but-2-enylidene]amino]-2,4-dinitro-aniline Openeye Name: N-[(E)-[1-[(1S)-cyclohex-3-en-1-yl]-3-methyl-but-2-enylidene]amino]-2,4-dinitro-aniline CAS Name: N-[(E)-[1-[(1S)-1-cyclohex-3-enyl]-3-methylbut-2-enylidene]amino]-2,4-dinitroaniline IUPAC Name: N-[(E)-[1-[(1S)-cyclohex-3-en-1-yl]-3-methylbut-2-enylidene]amino]-2,4-dinitroaniline Traditional Name: [(E)-[1-[(1S)-cyclohex-3-en-1-yl]-3-methyl-but-2-enylidene]amino]-(2,4-dinitrophenyl)amine Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C2CCC=CC2)C

Isomeric SMILES

CC(=C/C(=N/NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/[C@H]2CCC=CC2)C

InChI

InChI=1S/C17H20N4O4/c1-12(2)10-16(13-6-4-3-5-7-13)19-18-15-9-8-14(20(22)23)11-17(15)21(24)25/h3-4,8-11,13,18H,5-7H2,1-2H3/b19-16-/t13-/m1/s1