N-[(E)-[(3S,4S)-3,4-dimethylcyclohexylidene]amino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-[(3S,4S)-3,4-dimethylcyclohexylidene]amino]-2,4-dinitro-aniline Openeye Name: N-[(E)-[(3S,4S)-3,4-dimethylcyclohexylidene]amino]-2,4-dinitro-aniline CAS Name: N-[(E)-[(3S,4S)-3,4-dimethylcyclohexylidene]amino]-2,4-dinitroaniline IUPAC Name: N-[(E)-[(3S,4S)-3,4-dimethylcyclohexylidene]amino]-2,4-dinitroaniline Traditional Name: [(E)-[(3S,4S)-3,4-dimethylcyclohexylidene]amino]-(2,4-dinitrophenyl)amine Formula: C14H18N4O4 MolecularWeight: 306.31712

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])CC1C

Isomeric SMILES

C[C@H]1CC/C(=N\NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])/C[C@@H]1C

InChI

InChI=1S/C14H18N4O4/c1-9-3-4-11(7-10(9)2)15-16-13-6-5-12(17(19)20)8-14(13)18(21)22/h5-6,8-10,16H,3-4,7H2,1-2H3/b15-11+/t9-,10-/m0/s1