1-(3,4,5-triethoxyphenyl)carbonyl-2,1-benzothiazol-3-one

Systemtic Name: 1-(3,4,5-triethoxyphenyl)carbonyl-2,1-benzothiazol-3-one Openeye Name: 1-(3,4,5-triethoxybenzoyl)-2,1-benzothiazol-3-one CAS Name: 1-[oxo-(3,4,5-triethoxyphenyl)methyl]-2,1-benzothiazol-3-one IUPAC Name: 1-(3,4,5-triethoxybenzoyl)-2,1-benzothiazol-3-one Traditional Name: 1-(3,4,5-triethoxybenzoyl)-2,1-benzothiazol-3-one Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2C3=CC=CC=C3C(=O)S2

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2C3=CC=CC=C3C(=O)S2

InChI

InChI=1S/C20H21NO5S/c1-4-24-16-11-13(12-17(25-5-2)18(16)26-6-3)19(22)21-15-10-8-7-9-14(15)20(23)27-21/h7-12H,4-6H2,1-3H3