methyl 4-[(2R)-1-[methyl(phenyl)amino]-1-oxidanylidene-propan-2-yl]oxy-3-nitro-benzoate

Systemtic Name: methyl 4-[(2R)-1-[methyl(phenyl)amino]-1-oxidanylidene-propan-2-yl]oxy-3-nitro-benzoate Openeye Name: methyl 4-[(1R)-1-methyl-2-(N-methylanilino)-2-oxo-ethoxy]-3-nitro-benzoate CAS Name: 4-[(2R)-1-(N-methylanilino)-1-oxopropan-2-yl]oxy-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[(2R)-1-(N-methylanilino)-1-oxopropan-2-yl]oxy-3-nitrobenzoate Traditional Name: 4-[(1R)-2-keto-1-methyl-2-(N-methylanilino)ethoxy]-3-nitro-benzoic acid methyl ester Formula: C18H18N2O6 MolecularWeight: 358.34532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C1=CC=CC=C1)OC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)N(C)C1=CC=CC=C1)OC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O6/c1-12(17(21)19(2)14-7-5-4-6-8-14)26-16-10-9-13(18(22)25-3)11-15(16)20(23)24/h4-12H,1-3H3/t12-/m1/s1