[2-[2-(2-methoxyphenoxy)ethylamino]-2-oxidanylidene-ethyl] 4-pyrrol-1-ylbenzoate

Systemtic Name: [2-[2-(2-methoxyphenoxy)ethylamino]-2-oxidanylidene-ethyl] 4-pyrrol-1-ylbenzoate Openeye Name: [2-[2-(2-methoxyphenoxy)ethylamino]-2-oxo-ethyl] 4-pyrrol-1-ylbenzoate CAS Name: 4-(1-pyrrolyl)benzoic acid [2-[2-(2-methoxyphenoxy)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(2-methoxyphenoxy)ethylamino]-2-oxoethyl] 4-pyrrol-1-ylbenzoate Traditional Name: 4-pyrrol-1-ylbenzoic acid [2-keto-2-[2-(2-methoxyphenoxy)ethylamino]ethyl] ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCCNC(=O)COC(=O)C2=CC=C(C=C2)N3C=CC=C3

Isomeric SMILES

COC1=CC=CC=C1OCCNC(=O)COC(=O)C2=CC=C(C=C2)N3C=CC=C3

InChI

InChI=1S/C22H22N2O5/c1-27-19-6-2-3-7-20(19)28-15-12-23-21(25)16-29-22(26)17-8-10-18(11-9-17)24-13-4-5-14-24/h2-11,13-14H,12,15-16H2,1H3,(H,23,25)