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

Systemtic Name: methyl 3-[(5-chloranyl-2,4-dinitro-phenyl)carbonylamino]propanoate Openeye Name: methyl 3-[(5-chloro-2,4-dinitro-benzoyl)amino]propanoate CAS Name: 3-[[(5-chloro-2,4-dinitrophenyl)-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[(5-chloro-2,4-dinitrobenzoyl)amino]propanoate Traditional Name: 3-[(5-chloro-2,4-dinitro-benzoyl)amino]propionic acid methyl ester Formula: C11H10ClN3O7 MolecularWeight: 331.666

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNC(=O)C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])Cl

Isomeric SMILES

COC(=O)CCNC(=O)C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C11H10ClN3O7/c1-22-10(16)2-3-13-11(17)6-4-7(12)9(15(20)21)5-8(6)14(18)19/h4-5H,2-3H2,1H3,(H,13,17)