methyl 2-chloranyl-3-(4-methyl-3,5-dinitro-phenyl)propanoate

Systemtic Name: methyl 2-chloranyl-3-(4-methyl-3,5-dinitro-phenyl)propanoate Openeye Name: methyl 2-chloro-3-(4-methyl-3,5-dinitro-phenyl)propanoate CAS Name: 2-chloro-3-(4-methyl-3,5-dinitrophenyl)propanoic acid methyl ester IUPAC Name: methyl 2-chloro-3-(4-methyl-3,5-dinitrophenyl)propanoate Traditional Name: 2-chloro-3-(4-methyl-3,5-dinitro-phenyl)propionic acid methyl ester Formula: C11H11ClN2O6 MolecularWeight: 302.66784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])CC(C(=O)OC)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])CC(C(=O)OC)Cl)[N+](=O)[O-]

InChI

InChI=1S/C11H11ClN2O6/c1-6-9(13(16)17)4-7(5-10(6)14(18)19)3-8(12)11(15)20-2/h4-5,8H,3H2,1-2H3