1,1-bis(oxidanylidene)-2-[(3-propan-2-yloxyphenyl)methyl]-1,2-benzothiazol-3-one

Systemtic Name: 1,1-bis(oxidanylidene)-2-[(3-propan-2-yloxyphenyl)methyl]-1,2-benzothiazol-3-one Openeye Name: 2-[(3-isopropoxyphenyl)methyl]-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 1,1-dioxo-2-[(3-propan-2-yloxyphenyl)methyl]-1,2-benzothiazol-3-one IUPAC Name: 1,1-dioxo-2-[(3-propan-2-yloxyphenyl)methyl]-1,2-benzothiazol-3-one Traditional Name: 2-(3-isopropoxybenzyl)-1,1-diketo-1,2-benzothiazol-3-one Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)CN2C(=O)C3=CC=CC=C3S2(=O)=O

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)CN2C(=O)C3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C17H17NO4S/c1-12(2)22-14-7-5-6-13(10-14)11-18-17(19)15-8-3-4-9-16(15)23(18,20)21/h3-10,12H,11H2,1-2H3