methyl (2S)-2-[[4-(dimethylamino)-3-nitro-phenyl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[[4-(dimethylamino)-3-nitro-phenyl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[4-(dimethylamino)-3-nitro-benzoyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[[4-(dimethylamino)-3-nitrophenyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[4-(dimethylamino)-3-nitrobenzoyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[4-(dimethylamino)-3-nitro-benzoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C19H21N3O5 MolecularWeight: 371.38714

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O5/c1-21(2)16-10-9-14(12-17(16)22(25)26)18(23)20-15(19(24)27-3)11-13-7-5-4-6-8-13/h4-10,12,15H,11H2,1-3H3,(H,20,23)/t15-/m0/s1