3-[[4-(1,3-benzothiazol-2-yl)-3-methoxy-phenyl]methoxy]-2,2-dimethyl-propanal

Systemtic Name: 3-[[4-(1,3-benzothiazol-2-yl)-3-methoxy-phenyl]methoxy]-2,2-dimethyl-propanal Openeye Name: 3-[[4-(1,3-benzothiazol-2-yl)-3-methoxy-phenyl]methoxy]-2,2-dimethyl-propanal CAS Name: 3-[[4-(1,3-benzothiazol-2-yl)-3-methoxyphenyl]methoxy]-2,2-dimethylpropanal IUPAC Name: 3-[[4-(1,3-benzothiazol-2-yl)-3-methoxyphenyl]methoxy]-2,2-dimethylpropanal Traditional Name: 3-[4-(1,3-benzothiazol-2-yl)-3-methoxy-benzyl]oxy-2,2-dimethyl-propionaldehyde Formula: C20H21NO3S MolecularWeight: 355.45064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COCC1=CC(=C(C=C1)C2=NC3=CC=CC=C3S2)OC)C=O

Isomeric SMILES

CC(C)(COCC1=CC(=C(C=C1)C2=NC3=CC=CC=C3S2)OC)C=O

InChI

InChI=1S/C20H21NO3S/c1-20(2,12-22)13-24-11-14-8-9-15(17(10-14)23-3)19-21-16-6-4-5-7-18(16)25-19/h4-10,12H,11,13H2,1-3H3