(5-methyl-1,2-oxazol-3-yl)methyl 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoate

Systemtic Name: (5-methyl-1,2-oxazol-3-yl)methyl 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoate Openeye Name: (5-methylisoxazol-3-yl)methyl 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoate CAS Name: 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoic acid (5-methyl-3-isoxazolyl)methyl ester IUPAC Name: (5-methyl-1,2-oxazol-3-yl)methyl 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoate Traditional Name: 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoic acid (5-methylisoxazol-3-yl)methyl ester Formula: C21H20N2O5S MolecularWeight: 412.4589

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=NO1)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC4=CC=CC=C43

InChI

InChI=1S/C21H20N2O5S/c1-15-12-18(22-28-15)14-27-21(24)17-7-4-9-19(13-17)29(25,26)23-11-5-8-16-6-2-3-10-20(16)23/h2-4,6-7,9-10,12-13H,5,8,11,14H2,1H3