2-[(7-chloranyl-1,3-benzodioxol-5-yl)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-[(7-chloranyl-1,3-benzodioxol-5-yl)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C16H14ClNO4 MolecularWeight: 319.73966

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC2C1C(=O)N(C2=O)CC3=CC4=C(C(=C3)Cl)OCO4

Isomeric SMILES

C1C=CCC2C1C(=O)N(C2=O)CC3=CC4=C(C(=C3)Cl)OCO4

InChI

InChI=1S/C16H14ClNO4/c17-12-5-9(6-13-14(12)22-8-21-13)7-18-15(19)10-3-1-2-4-11(10)16(18)20/h1-2,5-6,10-11H,3-4,7-8H2