methyl 2-[(3,5-dinitrophenyl)carbonylamino]-3-(4-hydroxyphenyl)propanoate

Systemtic Name: methyl 2-[(3,5-dinitrophenyl)carbonylamino]-3-(4-hydroxyphenyl)propanoate Openeye Name: methyl 2-[(3,5-dinitrobenzoyl)amino]-3-(4-hydroxyphenyl)propanoate CAS Name: 2-[[(3,5-dinitrophenyl)-oxomethyl]amino]-3-(4-hydroxyphenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[(3,5-dinitrobenzoyl)amino]-3-(4-hydroxyphenyl)propanoate Traditional Name: 2-[(3,5-dinitrobenzoyl)amino]-3-(4-hydroxyphenyl)propionic acid methyl ester Formula: C17H15N3O8 MolecularWeight: 389.3163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N3O8/c1-28-17(23)15(6-10-2-4-14(21)5-3-10)18-16(22)11-7-12(19(24)25)9-13(8-11)20(26)27/h2-5,7-9,15,21H,6H2,1H3,(H,18,22)