4-methyl-6-[4-(phenylsulfonyl)butoxy]-1H-quinolin-2-one

Systemtic Name: 4-methyl-6-[4-(phenylsulfonyl)butoxy]-1H-quinolin-2-one Openeye Name: 6-[4-(benzenesulfonyl)butoxy]-4-methyl-1H-quinolin-2-one CAS Name: 6-[4-(benzenesulfonyl)butoxy]-4-methyl-1H-quinolin-2-one IUPAC Name: 6-[4-(benzenesulfonyl)butoxy]-4-methyl-1H-quinolin-2-one Traditional Name: 6-(4-besylbutoxy)-4-methyl-carbostyril Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)NC2=C1C=C(C=C2)OCCCCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=O)NC2=C1C=C(C=C2)OCCCCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H21NO4S/c1-15-13-20(22)21-19-10-9-16(14-18(15)19)25-11-5-6-12-26(23,24)17-7-3-2-4-8-17/h2-4,7-10,13-14H,5-6,11-12H2,1H3,(H,21,22)