3-[(4-butoxy-3-methoxy-phenyl)methyl]-1,3-benzothiazol-2-one

Systemtic Name: 3-[(4-butoxy-3-methoxy-phenyl)methyl]-1,3-benzothiazol-2-one Openeye Name: 3-[(4-butoxy-3-methoxy-phenyl)methyl]-1,3-benzothiazol-2-one CAS Name: 3-[(4-butoxy-3-methoxyphenyl)methyl]-1,3-benzothiazol-2-one IUPAC Name: 3-[(4-butoxy-3-methoxyphenyl)methyl]-1,3-benzothiazol-2-one Traditional Name: 3-(4-butoxy-3-methoxy-benzyl)-1,3-benzothiazol-2-one Formula: C19H21NO3S MolecularWeight: 343.43994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CN2C3=CC=CC=C3SC2=O)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CN2C3=CC=CC=C3SC2=O)OC

InChI

InChI=1S/C19H21NO3S/c1-3-4-11-23-16-10-9-14(12-17(16)22-2)13-20-15-7-5-6-8-18(15)24-19(20)21/h5-10,12H,3-4,11,13H2,1-2H3