2-[3-(3,5-dimethylphenoxy)propyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one

Systemtic Name: 2-[3-(3,5-dimethylphenoxy)propyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 2-[3-(3,5-dimethylphenoxy)propyl]-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-[3-(3,5-dimethylphenoxy)propyl]-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 2-[3-(3,5-dimethylphenoxy)propyl]-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 2-[3-(3,5-dimethylphenoxy)propyl]-1,1-diketo-1,2-benzothiazol-3-one Formula: C18H19NO4S MolecularWeight: 345.41276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCCN2C(=O)C3=CC=CC=C3S2(=O)=O)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCCN2C(=O)C3=CC=CC=C3S2(=O)=O)C

InChI

InChI=1S/C18H19NO4S/c1-13-10-14(2)12-15(11-13)23-9-5-8-19-18(20)16-6-3-4-7-17(16)24(19,21)22/h3-4,6-7,10-12H,5,8-9H2,1-2H3