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

Systemtic Name: 3-(3,4-dichlorophenyl)-3-(2-methyl-3-oxidanylidene-4-propan-2-yloxy-1H-isoindol-1-yl)propanal Openeye Name: 3-(3,4-dichlorophenyl)-3-(4-isopropoxy-2-methyl-3-oxo-isoindolin-1-yl)propanal CAS Name: 3-(3,4-dichlorophenyl)-3-(2-methyl-3-oxo-4-propan-2-yloxy-1H-isoindol-1-yl)propanal IUPAC Name: 3-(3,4-dichlorophenyl)-3-(2-methyl-3-oxo-4-propan-2-yloxy-1H-isoindol-1-yl)propanal Traditional Name: 3-(3,4-dichlorophenyl)-3-(4-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=CC=CC2=C1C(=O)N(C2C(CC=O)C3=CC(=C(C=C3)Cl)Cl)C

Isomeric SMILES

CC(C)OC1=CC=CC2=C1C(=O)N(C2C(CC=O)C3=CC(=C(C=C3)Cl)Cl)C

InChI

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