6-[4-(3,4-dimethoxyphenyl)sulfinylbutoxy]-4,4-dimethyl-1H-3,1-benzoxazin-2-one

Systemtic Name: 6-[4-(3,4-dimethoxyphenyl)sulfinylbutoxy]-4,4-dimethyl-1H-3,1-benzoxazin-2-one Openeye Name: 6-[4-(3,4-dimethoxyphenyl)sulfinylbutoxy]-4,4-dimethyl-1H-3,1-benzoxazin-2-one CAS Name: 6-[4-(3,4-dimethoxyphenyl)sulfinylbutoxy]-4,4-dimethyl-1H-3,1-benzoxazin-2-one IUPAC Name: 6-[4-(3,4-dimethoxyphenyl)sulfinylbutoxy]-4,4-dimethyl-1H-3,1-benzoxazin-2-one Traditional Name: 6-[4-(3,4-dimethoxyphenyl)sulfinylbutoxy]-4,4-dimethyl-1H-3,1-benzoxazin-2-one Formula: C22H27NO6S MolecularWeight: 433.51788

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)OCCCCS(=O)C3=CC(=C(C=C3)OC)OC)NC(=O)O1)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)OCCCCS(=O)C3=CC(=C(C=C3)OC)OC)NC(=O)O1)C

InChI

InChI=1S/C22H27NO6S/c1-22(2)17-13-15(7-9-18(17)23-21(24)29-22)28-11-5-6-12-30(25)16-8-10-19(26-3)20(14-16)27-4/h7-10,13-14H,5-6,11-12H2,1-4H3,(H,23,24)