(4-ethyl-2-oxidanylidene-chromen-7-yl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate

Systemtic Name: (4-ethyl-2-oxidanylidene-chromen-7-yl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Openeye Name: (4-ethyl-2-oxo-chromen-7-yl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-2-propenoic acid (4-ethyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-ethyl-2-oxochromen-7-yl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)acrylic acid (4-ethyl-2-keto-chromen-7-yl) ester Formula: C21H15NO4S MolecularWeight: 377.4131

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C=CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)/C=C/C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H15NO4S/c1-2-13-11-21(24)26-17-12-14(7-8-15(13)17)25-20(23)10-9-19-22-16-5-3-4-6-18(16)27-19/h3-12H,2H2,1H3/b10-9+