3-(3,4-dichlorophenyl)-3-(2-methyl-3-oxidanylidene-5-propan-2-yloxy-1H-isoindol-1-yl)propanal

Systemtic Name: 3-(3,4-dichlorophenyl)-3-(2-methyl-3-oxidanylidene-5-propan-2-yloxy-1H-isoindol-1-yl)propanal Openeye Name: 3-(3,4-dichlorophenyl)-3-(5-isopropoxy-2-methyl-3-oxo-isoindolin-1-yl)propanal CAS Name: 3-(3,4-dichlorophenyl)-3-(2-methyl-3-oxo-5-propan-2-yloxy-1H-isoindol-1-yl)propanal IUPAC Name: 3-(3,4-dichlorophenyl)-3-(2-methyl-3-oxo-5-propan-2-yloxy-1H-isoindol-1-yl)propanal Traditional Name: 3-(3,4-dichlorophenyl)-3-(5-isopropoxy-3-keto-2-methyl-isoindolin-1-yl)propionaldehyde Formula: C21H21Cl2NO3 MolecularWeight: 406.30234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC2=C(C=C1)C(N(C2=O)C)C(CC=O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C)OC1=CC2=C(C=C1)C(N(C2=O)C)C(CC=O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H21Cl2NO3/c1-12(2)27-14-5-6-16-17(11-14)21(26)24(3)20(16)15(8-9-25)13-4-7-18(22)19(23)10-13/h4-7,9-12,15,20H,8H2,1-3H3