methyl 4-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxidanylidene-ethoxy]-3-nitro-benzoate

Systemtic Name: methyl 4-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxidanylidene-ethoxy]-3-nitro-benzoate Openeye Name: methyl 4-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxo-ethoxy]-3-nitro-benzoate CAS Name: 4-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethoxy]-3-nitrobenzoate Traditional Name: 4-[2-keto-2-[2-(4-methoxyphenyl)ethylamino]ethoxy]-3-nitro-benzoic acid methyl ester Formula: C19H20N2O7 MolecularWeight: 388.3713

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)COC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)COC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O7/c1-26-15-6-3-13(4-7-15)9-10-20-18(22)12-28-17-8-5-14(19(23)27-2)11-16(17)21(24)25/h3-8,11H,9-10,12H2,1-2H3,(H,20,22)