[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 4-(4-chloranyl-3-methyl-phenoxy)butanoate

Systemtic Name: [2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 4-(4-chloranyl-3-methyl-phenoxy)butanoate Openeye Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 4-(4-chloro-3-methyl-phenoxy)butanoate CAS Name: 4-(4-chloro-3-methylphenoxy)butanoic acid [2-oxo-2-(1H-pyrrol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 4-(4-chloro-3-methylphenoxy)butanoate Traditional Name: 4-(4-chloro-3-methyl-phenoxy)butyric acid [2-keto-2-(1H-pyrrol-2-yl)ethyl] ester Formula: C17H18ClNO4 MolecularWeight: 335.78212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCC(=O)OCC(=O)C2=CC=CN2)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCCCC(=O)OCC(=O)C2=CC=CN2)Cl

InChI

InChI=1S/C17H18ClNO4/c1-12-10-13(6-7-14(12)18)22-9-3-5-17(21)23-11-16(20)15-4-2-8-19-15/h2,4,6-8,10,19H,3,5,9,11H2,1H3