[2-[(1-methylpyrrol-2-yl)carbonylamino]-2-oxidanylidene-ethyl] 4-phenoxybutanoate

Systemtic Name: [2-[(1-methylpyrrol-2-yl)carbonylamino]-2-oxidanylidene-ethyl] 4-phenoxybutanoate Openeye Name: [2-[(1-methylpyrrole-2-carbonyl)amino]-2-oxo-ethyl] 4-phenoxybutanoate CAS Name: 4-phenoxybutanoic acid [2-[[(1-methyl-2-pyrrolyl)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-methylpyrrole-2-carbonyl)amino]-2-oxoethyl] 4-phenoxybutanoate Traditional Name: 4-phenoxybutyric acid [2-keto-2-[(1-methylpyrrole-2-carbonyl)amino]ethyl] ester Formula: C18H20N2O5 MolecularWeight: 344.3618

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)NC(=O)COC(=O)CCCOC2=CC=CC=C2

Isomeric SMILES

CN1C=CC=C1C(=O)NC(=O)COC(=O)CCCOC2=CC=CC=C2

InChI

InChI=1S/C18H20N2O5/c1-20-11-5-9-15(20)18(23)19-16(21)13-25-17(22)10-6-12-24-14-7-3-2-4-8-14/h2-5,7-9,11H,6,10,12-13H2,1H3,(H,19,21,23)