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

Systemtic Name: methyl 2-[(4-chloranyl-3,5-dinitro-phenyl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[(4-chloro-3,5-dinitro-benzoyl)amino]-3-phenyl-propanoate CAS Name: 2-[[(4-chloro-3,5-dinitrophenyl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[(4-chloro-3,5-dinitrobenzoyl)amino]-3-phenylpropanoate Traditional Name: 2-[(4-chloro-3,5-dinitro-benzoyl)amino]-3-phenyl-propionic acid methyl ester Formula: C17H14ClN3O7 MolecularWeight: 407.76196

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H14ClN3O7/c1-28-17(23)12(7-10-5-3-2-4-6-10)19-16(22)11-8-13(20(24)25)15(18)14(9-11)21(26)27/h2-6,8-9,12H,7H2,1H3,(H,19,22)