(4,8-dimethyl-2-oxidanylidene-chromen-7-yl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate

Systemtic Name: (4,8-dimethyl-2-oxidanylidene-chromen-7-yl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Openeye Name: (4,8-dimethyl-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 (4,8-dimethyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4,8-dimethyl-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 (2-keto-4,8-dimethyl-chromen-7-yl) ester Formula: C21H15NO4S MolecularWeight: 377.4131

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2C)OC(=O)C=CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2C)OC(=O)/C=C/C3=NC4=CC=CC=C4S3

InChI

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