methyl 4-oxidanylidene-4-(3-pyrrol-1-yl-1-benzofuran-2-yl)butanoate

Systemtic Name: methyl 4-oxidanylidene-4-(3-pyrrol-1-yl-1-benzofuran-2-yl)butanoate Openeye Name: methyl 4-oxo-4-(3-pyrrol-1-ylbenzofuran-2-yl)butanoate CAS Name: 4-oxo-4-[3-(1-pyrrolyl)-2-benzofuranyl]butanoic acid methyl ester IUPAC Name: methyl 4-oxo-4-(3-pyrrol-1-yl-1-benzofuran-2-yl)butanoate Traditional Name: 4-keto-4-(3-pyrrol-1-ylbenzofuran-2-yl)butyric acid methyl ester Formula: C17H15NO4 MolecularWeight: 297.3053

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)C1=C(C2=CC=CC=C2O1)N3C=CC=C3

Isomeric SMILES

COC(=O)CCC(=O)C1=C(C2=CC=CC=C2O1)N3C=CC=C3

InChI

InChI=1S/C17H15NO4/c1-21-15(20)9-8-13(19)17-16(18-10-4-5-11-18)12-6-2-3-7-14(12)22-17/h2-7,10-11H,8-9H2,1H3