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

Systemtic Name: methyl 2-[(2,4-dinitrophenyl)carbonylamino]-3-(4-hydroxyphenyl)propanoate Openeye Name: methyl 2-[(2,4-dinitrobenzoyl)amino]-3-(4-hydroxyphenyl)propanoate CAS Name: 2-[[(2,4-dinitrophenyl)-oxomethyl]amino]-3-(4-hydroxyphenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[(2,4-dinitrobenzoyl)amino]-3-(4-hydroxyphenyl)propanoate Traditional Name: 2-[(2,4-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=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

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

InChI

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