(3-oxidanylidenebenzo[f]chromen-1-yl)methyl (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-2-propenoic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)acrylic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C24H15NO4S MolecularWeight: 413.4452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)COC(=O)C=CC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)COC(=O)/C=C/C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H15NO4S/c26-22(12-11-21-25-18-7-3-4-8-20(18)30-21)28-14-16-13-23(27)29-19-10-9-15-5-1-2-6-17(15)24(16)19/h1-13H,14H2/b12-11+