N-[(E)-(1-dimethoxyphosphoryl-4-methyl-cyclohex-3-en-1-yl)methylideneamino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-(1-dimethoxyphosphoryl-4-methyl-cyclohex-3-en-1-yl)methylideneamino]-2,4-dinitro-aniline Openeye Name: N-[(E)-(1-dimethoxyphosphoryl-4-methyl-cyclohex-3-en-1-yl)methyleneamino]-2,4-dinitro-aniline CAS Name: N-[(E)-(1-dimethoxyphosphoryl-4-methyl-1-cyclohex-3-enyl)methylideneamino]-2,4-dinitroaniline IUPAC Name: N-[(E)-(1-dimethoxyphosphoryl-4-methylcyclohex-3-en-1-yl)methylideneamino]-2,4-dinitroaniline Traditional Name: [(E)-(1-dimethoxyphosphoryl-4-methyl-cyclohex-3-en-1-yl)methyleneamino]-(2,4-dinitrophenyl)amine Formula: C16H21N4O7P MolecularWeight: 412.334301

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(CC1)(C=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])P(=O)(OC)OC

Isomeric SMILES

CC1=CCC(CC1)(/C=N/NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])P(=O)(OC)OC

InChI

InChI=1S/C16H21N4O7P/c1-12-6-8-16(9-7-12,28(25,26-2)27-3)11-17-18-14-5-4-13(19(21)22)10-15(14)20(23)24/h4-6,10-11,18H,7-9H2,1-3H3/b17-11+