methyl 3-methoxy-4-methyl-5-(methylamino)-2,6-dinitro-benzoate

Systemtic Name: methyl 3-methoxy-4-methyl-5-(methylamino)-2,6-dinitro-benzoate Openeye Name: methyl 3-methoxy-4-methyl-5-(methylamino)-2,6-dinitro-benzoate CAS Name: 3-methoxy-4-methyl-5-(methylamino)-2,6-dinitrobenzoic acid methyl ester IUPAC Name: methyl 3-methoxy-4-methyl-5-(methylamino)-2,6-dinitrobenzoate Traditional Name: 3-methoxy-4-methyl-5-(methylamino)-2,6-dinitro-benzoic acid methyl ester Formula: C11H13N3O7 MolecularWeight: 299.23682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1OC)[N+](=O)[O-])C(=O)OC)[N+](=O)[O-])NC

Isomeric SMILES

CC1=C(C(=C(C(=C1OC)[N+](=O)[O-])C(=O)OC)[N+](=O)[O-])NC

InChI

InChI=1S/C11H13N3O7/c1-5-7(12-2)8(13(16)17)6(11(15)21-4)9(14(18)19)10(5)20-3/h12H,1-4H3