5,6-dimethoxy-4-propan-2-yl-2-[[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]methyl]naphthalene-1-carboxylate

Systemtic Name: 5,6-dimethoxy-4-propan-2-yl-2-[[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]methyl]naphthalene-1-carboxylate Openeye Name: 4-isopropyl-5,6-dimethoxy-2-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]naphthalene-1-carboxylate CAS Name: 5,6-dimethoxy-4-propan-2-yl-2-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]-1-naphthalenecarboxylate IUPAC Name: 5,6-dimethoxy-4-propan-2-yl-2-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]naphthalene-1-carboxylate Traditional Name: 4-isopropyl-5,6-dimethoxy-2-[(1,1,3-triketo-1,2-benzothiazol-2-yl)methyl]-1-naphthoate Formula: C24H22NO7S- MolecularWeight: 468.49898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C2=C1C(=C(C=C2)OC)OC)C(=O)[O-])CN3C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

CC(C)C1=CC(=C(C2=C1C(=C(C=C2)OC)OC)C(=O)[O-])CN3C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C24H23NO7S/c1-13(2)17-11-14(12-25-23(26)15-7-5-6-8-19(15)33(25,29)30)20(24(27)28)16-9-10-18(31-3)22(32-4)21(16)17/h5-11,13H,12H2,1-4H3,(H,27,28)/p-1