(5-chloranyl-2-methoxy-phenyl)methyl 2-[(3-methyl-4-nitro-phenyl)carbonylamino]ethanoate

Systemtic Name: (5-chloranyl-2-methoxy-phenyl)methyl 2-[(3-methyl-4-nitro-phenyl)carbonylamino]ethanoate Openeye Name: (5-chloro-2-methoxy-phenyl)methyl 2-[(3-methyl-4-nitro-benzoyl)amino]acetate CAS Name: 2-[[(3-methyl-4-nitrophenyl)-oxomethyl]amino]acetic acid (5-chloro-2-methoxyphenyl)methyl ester IUPAC Name: (5-chloro-2-methoxyphenyl)methyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate Traditional Name: 2-[(3-methyl-4-nitro-benzoyl)amino]acetic acid (5-chloro-2-methoxy-benzyl) ester Formula: C18H17ClN2O6 MolecularWeight: 392.79038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC(=O)OCC2=C(C=CC(=C2)Cl)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCC(=O)OCC2=C(C=CC(=C2)Cl)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN2O6/c1-11-7-12(3-5-15(11)21(24)25)18(23)20-9-17(22)27-10-13-8-14(19)4-6-16(13)26-2/h3-8H,9-10H2,1-2H3,(H,20,23)