methyl (2R)-4-(1,3-benzothiazol-2-ylmethyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylate

Systemtic Name: methyl (2R)-4-(1,3-benzothiazol-2-ylmethyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylate Openeye Name: methyl (2R)-4-(1,3-benzothiazol-2-ylmethyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylate CAS Name: (2R)-4-(1,3-benzothiazol-2-ylmethyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid methyl ester IUPAC Name: methyl (2R)-4-(1,3-benzothiazol-2-ylmethyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylate Traditional Name: (2R)-4-(1,3-benzothiazol-2-ylmethyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid methyl ester Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(C2=CC=CC=C2O1)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC(=O)[C@H]1CN(C2=CC=CC=C2O1)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H16N2O3S/c1-22-18(21)15-10-20(13-7-3-4-8-14(13)23-15)11-17-19-12-6-2-5-9-16(12)24-17/h2-9,15H,10-11H2,1H3/t15-/m1/s1