1-(3,4-diethoxyphenyl)carbonyl-2,1-benzothiazol-3-one

Systemtic Name: 1-(3,4-diethoxyphenyl)carbonyl-2,1-benzothiazol-3-one Openeye Name: 1-(3,4-diethoxybenzoyl)-2,1-benzothiazol-3-one CAS Name: 1-[(3,4-diethoxyphenyl)-oxomethyl]-2,1-benzothiazol-3-one IUPAC Name: 1-(3,4-diethoxybenzoyl)-2,1-benzothiazol-3-one Traditional Name: 1-(3,4-diethoxybenzoyl)-2,1-benzothiazol-3-one Formula: C18H17NO4S MolecularWeight: 343.39688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N2C3=CC=CC=C3C(=O)S2)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N2C3=CC=CC=C3C(=O)S2)OCC

InChI

InChI=1S/C18H17NO4S/c1-3-22-15-10-9-12(11-16(15)23-4-2)17(20)19-14-8-6-5-7-13(14)18(21)24-19/h5-11H,3-4H2,1-2H3