2-(3-chloranyl-4-methoxy-phenyl)-5,6-dimethyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-(3-chloranyl-4-methoxy-phenyl)-5,6-dimethyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-(3-chloro-4-methoxy-phenyl)-5,6-dimethyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-(3-chloro-4-methoxyphenyl)-5,6-dimethyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-(3-chloro-4-methoxyphenyl)-5,6-dimethyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-(3-chloro-4-methoxy-phenyl)-5,6-dimethyl-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C17H18ClNO3 MolecularWeight: 319.78272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC2C(C1)C(=O)N(C2=O)C3=CC(=C(C=C3)OC)Cl)C

Isomeric SMILES

CC1=C(CC2C(C1)C(=O)N(C2=O)C3=CC(=C(C=C3)OC)Cl)C

InChI

InChI=1S/C17H18ClNO3/c1-9-6-12-13(7-10(9)2)17(21)19(16(12)20)11-4-5-15(22-3)14(18)8-11/h4-5,8,12-13H,6-7H2,1-3H3