2-(3-chloranyl-4-methoxy-phenyl)-4-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-(3-chloranyl-4-methoxy-phenyl)-4-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-(3-chloro-4-methoxy-phenyl)-4-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-(3-chloro-4-methoxyphenyl)-4-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-(3-chloro-4-methoxyphenyl)-4-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-(3-chloro-4-methoxy-phenyl)-4-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C16H16ClNO3 MolecularWeight: 305.75614

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CCC2C1C(=O)N(C2=O)C3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CC1C=CCC2C1C(=O)N(C2=O)C3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C16H16ClNO3/c1-9-4-3-5-11-14(9)16(20)18(15(11)19)10-6-7-13(21-2)12(17)8-10/h3-4,6-9,11,14H,5H2,1-2H3