ethyl 2-[1-[[6,7-bis(fluoranyl)-1,3-benzothiazol-2-yl]methyl]-7-chloranyl-2-oxidanylidene-3,4-dihydroquinolin-3-yl]ethanoate

Systemtic Name: ethyl 2-[1-[[6,7-bis(fluoranyl)-1,3-benzothiazol-2-yl]methyl]-7-chloranyl-2-oxidanylidene-3,4-dihydroquinolin-3-yl]ethanoate Openeye Name: ethyl 2-[7-chloro-1-[(6,7-difluoro-1,3-benzothiazol-2-yl)methyl]-2-oxo-3,4-dihydroquinolin-3-yl]acetate CAS Name: 2-[7-chloro-1-[(6,7-difluoro-1,3-benzothiazol-2-yl)methyl]-2-oxo-3,4-dihydroquinolin-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[7-chloro-1-[(6,7-difluoro-1,3-benzothiazol-2-yl)methyl]-2-oxo-3,4-dihydroquinolin-3-yl]acetate Traditional Name: 2-[7-chloro-1-[(6,7-difluoro-1,3-benzothiazol-2-yl)methyl]-2-keto-3,4-dihydroquinolin-3-yl]acetic acid ethyl ester Formula: C21H17ClF2N2O3S MolecularWeight: 450.886086

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CC2=C(C=C(C=C2)Cl)N(C1=O)CC3=NC4=C(S3)C(=C(C=C4)F)F

Isomeric SMILES

CCOC(=O)CC1CC2=C(C=C(C=C2)Cl)N(C1=O)CC3=NC4=C(S3)C(=C(C=C4)F)F

InChI

InChI=1S/C21H17ClF2N2O3S/c1-2-29-18(27)8-12-7-11-3-4-13(22)9-16(11)26(21(12)28)10-17-25-15-6-5-14(23)19(24)20(15)30-17/h3-6,9,12H,2,7-8,10H2,1H3