ethyl 3-[(3,5-dinitrophenyl)carbonyl-(phenylmethyl)amino]propanoate

Systemtic Name: ethyl 3-[(3,5-dinitrophenyl)carbonyl-(phenylmethyl)amino]propanoate Openeye Name: ethyl 3-[benzyl-(3,5-dinitrobenzoyl)amino]propanoate CAS Name: 3-[[(3,5-dinitrophenyl)-oxomethyl]-(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[benzyl-(3,5-dinitrobenzoyl)amino]propanoate Traditional Name: 3-[benzyl-(3,5-dinitrobenzoyl)amino]propionic acid ethyl ester Formula: C19H19N3O7 MolecularWeight: 401.37006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CC=C1)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CC=C1)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O7/c1-2-29-18(23)8-9-20(13-14-6-4-3-5-7-14)19(24)15-10-16(21(25)26)12-17(11-15)22(27)28/h3-7,10-12H,2,8-9,13H2,1H3