4-[[4-[(3-chlorophenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-2-ylidene]methyl]benzoate

Systemtic Name: 4-[[4-[(3-chlorophenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-2-ylidene]methyl]benzoate Openeye Name: 4-[[4-[(3-chlorophenyl)methyl]-3-oxo-1,4-benzothiazin-2-ylidene]methyl]benzoate CAS Name: 4-[[4-[(3-chlorophenyl)methyl]-3-oxo-1,4-benzothiazin-2-ylidene]methyl]benzoate IUPAC Name: 4-[[4-[(3-chlorophenyl)methyl]-3-oxo-1,4-benzothiazin-2-ylidene]methyl]benzoate Traditional Name: 4-[[4-(3-chlorobenzyl)-3-keto-1,4-benzothiazin-2-ylidene]methyl]benzoate Formula: C23H15ClNO3S- MolecularWeight: 420.8881

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=O)C(=CC3=CC=C(C=C3)C(=O)[O-])S2)CC4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=O)C(=CC3=CC=C(C=C3)C(=O)[O-])S2)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H16ClNO3S/c24-18-5-3-4-16(12-18)14-25-19-6-1-2-7-20(19)29-21(22(25)26)13-15-8-10-17(11-9-15)23(27)28/h1-13H,14H2,(H,27,28)/p-1