ethyl (2S)-2-[3-[(4-chloranyl-2-nitro-phenyl)carbonylamino]-4-methyl-phenoxy]propanoate

Systemtic Name: ethyl (2S)-2-[3-[(4-chloranyl-2-nitro-phenyl)carbonylamino]-4-methyl-phenoxy]propanoate Openeye Name: ethyl (2S)-2-[3-[(4-chloro-2-nitro-benzoyl)amino]-4-methyl-phenoxy]propanoate CAS Name: (2S)-2-[3-[[(4-chloro-2-nitrophenyl)-oxomethyl]amino]-4-methylphenoxy]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[3-[(4-chloro-2-nitrobenzoyl)amino]-4-methylphenoxy]propanoate Traditional Name: (2S)-2-[3-[(4-chloro-2-nitro-benzoyl)amino]-4-methyl-phenoxy]propionic acid ethyl ester Formula: C19H19ClN2O6 MolecularWeight: 406.81696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=CC(=C(C=C1)C)NC(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)[C@H](C)OC1=CC(=C(C=C1)C)NC(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H19ClN2O6/c1-4-27-19(24)12(3)28-14-7-5-11(2)16(10-14)21-18(23)15-8-6-13(20)9-17(15)22(25)26/h5-10,12H,4H2,1-3H3,(H,21,23)/t12-/m0/s1