methyl 4-[3-[2-(5-chloranylquinolin-8-yl)oxyethanoyl]-2,5-dimethyl-pyrrol-1-yl]butanoate

Systemtic Name: methyl 4-[3-[2-(5-chloranylquinolin-8-yl)oxyethanoyl]-2,5-dimethyl-pyrrol-1-yl]butanoate Openeye Name: methyl 4-[3-[2-[(5-chloro-8-quinolyl)oxy]acetyl]-2,5-dimethyl-pyrrol-1-yl]butanoate CAS Name: 4-[3-[2-[(5-chloro-8-quinolinyl)oxy]-1-oxoethyl]-2,5-dimethyl-1-pyrrolyl]butanoic acid methyl ester IUPAC Name: methyl 4-[3-[2-(5-chloroquinolin-8-yl)oxyacetyl]-2,5-dimethylpyrrol-1-yl]butanoate Traditional Name: 4-[3-[2-[(5-chloro-8-quinolyl)oxy]acetyl]-2,5-dimethyl-pyrrol-1-yl]butyric acid methyl ester Formula: C22H23ClN2O4 MolecularWeight: 414.88202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCCC(=O)OC)C)C(=O)COC2=C3C(=C(C=C2)Cl)C=CC=N3

Isomeric SMILES

CC1=CC(=C(N1CCCC(=O)OC)C)C(=O)COC2=C3C(=C(C=C2)Cl)C=CC=N3

InChI

InChI=1S/C22H23ClN2O4/c1-14-12-17(15(2)25(14)11-5-7-21(27)28-3)19(26)13-29-20-9-8-18(23)16-6-4-10-24-22(16)20/h4,6,8-10,12H,5,7,11,13H2,1-3H3