methyl 3-[[(E)-3-(1,3-benzothiazol-2-yl)prop-2-enoyl]oxymethyl]benzoate

Systemtic Name: methyl 3-[[(E)-3-(1,3-benzothiazol-2-yl)prop-2-enoyl]oxymethyl]benzoate Openeye Name: methyl 3-[[(E)-3-(1,3-benzothiazol-2-yl)prop-2-enoyl]oxymethyl]benzoate CAS Name: 3-[[(E)-3-(1,3-benzothiazol-2-yl)-1-oxoprop-2-enoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[(E)-3-(1,3-benzothiazol-2-yl)prop-2-enoyl]oxymethyl]benzoate Traditional Name: 3-[[(E)-3-(1,3-benzothiazol-2-yl)acryloyl]oxymethyl]benzoic acid methyl ester Formula: C19H15NO4S MolecularWeight: 353.3917

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)COC(=O)C=CC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)COC(=O)/C=C/C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H15NO4S/c1-23-19(22)14-6-4-5-13(11-14)12-24-18(21)10-9-17-20-15-7-2-3-8-16(15)25-17/h2-11H,12H2,1H3/b10-9+