(4-propan-2-ylphenyl)methyl 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate

Systemtic Name: (4-propan-2-ylphenyl)methyl 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate Openeye Name: (4-isopropylphenyl)methyl 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate CAS Name: 3-(3-oxo-1,4-benzothiazin-4-yl)propanoic acid (4-propan-2-ylphenyl)methyl ester IUPAC Name: (4-propan-2-ylphenyl)methyl 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate Traditional Name: 3-(3-keto-1,4-benzothiazin-4-yl)propionic acid (4-isopropylbenzyl) ester Formula: C21H23NO3S MolecularWeight: 369.47722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)COC(=O)CCN2C(=O)CSC3=CC=CC=C32

Isomeric SMILES

CC(C)C1=CC=C(C=C1)COC(=O)CCN2C(=O)CSC3=CC=CC=C32

InChI

InChI=1S/C21H23NO3S/c1-15(2)17-9-7-16(8-10-17)13-25-21(24)11-12-22-18-5-3-4-6-19(18)26-14-20(22)23/h3-10,15H,11-14H2,1-2H3