[2-[2-(2-methoxyphenoxy)ethylamino]-2-oxidanylidene-ethyl] 3-methyl-4-nitro-benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OCC(=O)NCCOC2=CC=CC=C2OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OCC(=O)NCCOC2=CC=CC=C2OC)[N+](=O)[O-]

InChI

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