butyl 4-[2-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: butyl 4-[2-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxidanylidene-ethoxy]benzoate Openeye Name: butyl 4-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxo-ethoxy]benzoate CAS Name: 4-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethoxy]benzoic acid butyl ester IUPAC Name: butyl 4-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethoxy]benzoate Traditional Name: 4-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-keto-ethoxy]benzoic acid butyl ester Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)OCC(=O)C2=C(C(=C(N2)C)C(=O)C)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)OCC(=O)C2=C(C(=C(N2)C)C(=O)C)C

InChI

InChI=1S/C21H25NO5/c1-5-6-11-26-21(25)16-7-9-17(10-8-16)27-12-18(24)20-13(2)19(15(4)23)14(3)22-20/h7-10,22H,5-6,11-12H2,1-4H3