[4-(6-methylheptyl)-2,6-dinitro-phenyl] (Z)-but-2-enoate

Systemtic Name: [4-(6-methylheptyl)-2,6-dinitro-phenyl] (Z)-but-2-enoate Openeye Name: [4-(6-methylheptyl)-2,6-dinitro-phenyl] (Z)-but-2-enoate CAS Name: (Z)-2-butenoic acid [4-(6-methylheptyl)-2,6-dinitrophenyl] ester IUPAC Name: [4-(6-methylheptyl)-2,6-dinitrophenyl] (Z)-but-2-enoate Traditional Name: (Z)-but-2-enoic acid [4-(6-methylheptyl)-2,6-dinitro-phenyl] ester Formula: C18H24N2O6 MolecularWeight: 364.39296

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)OC1=C(C=C(C=C1[N+](=O)[O-])CCCCCC(C)C)[N+](=O)[O-]

Isomeric SMILES

C/C=C\C(=O)OC1=C(C=C(C=C1[N+](=O)[O-])CCCCCC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C18H24N2O6/c1-4-8-17(21)26-18-15(19(22)23)11-14(12-16(18)20(24)25)10-7-5-6-9-13(2)3/h4,8,11-13H,5-7,9-10H2,1-3H3/b8-4-