ethyl (2S)-2-[(2,4-dinitrophenyl)amino]-3-phenyl-propanoate

Systemtic Name: ethyl (2S)-2-[(2,4-dinitrophenyl)amino]-3-phenyl-propanoate Openeye Name: ethyl (2S)-2-(2,4-dinitroanilino)-3-phenyl-propanoate CAS Name: (2S)-2-(2,4-dinitroanilino)-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-(2,4-dinitroanilino)-3-phenylpropanoate Traditional Name: (2S)-2-(2,4-dinitroanilino)-3-phenyl-propionic acid ethyl ester Formula: C17H17N3O6 MolecularWeight: 359.33338

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)[C@H](CC1=CC=CC=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O6/c1-2-26-17(21)15(10-12-6-4-3-5-7-12)18-14-9-8-13(19(22)23)11-16(14)20(24)25/h3-9,11,15,18H,2,10H2,1H3/t15-/m0/s1