(3aS,6E,7aS)-2-butyl-6-hydroxyimino-4,5,7,7a-tetrahydro-3aH-isoindole-1,3-dione

Systemtic Name: (3aS,6E,7aS)-2-butyl-6-hydroxyimino-4,5,7,7a-tetrahydro-3aH-isoindole-1,3-dione Openeye Name: (3aS,6E,7aS)-2-butyl-6-hydroxyimino-4,5,7,7a-tetrahydro-3aH-isoindole-1,3-dione CAS Name: (3aS,6E,7aS)-2-butyl-6-hydroxyimino-4,5,7,7a-tetrahydro-3aH-isoindole-1,3-dione IUPAC Name: (3aS,6E,7aS)-2-butyl-6-hydroxyimino-4,5,7,7a-tetrahydro-3aH-isoindole-1,3-dione Traditional Name: (3aS,6E,7aS)-2-butyl-6-hydroximino-4,5,7,7a-tetrahydro-3aH-isoindole-1,3-quinone Formula: C12H18N2O3 MolecularWeight: 238.28292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2CCC(=NO)CC2C1=O

Isomeric SMILES

CCCCN1C(=O)[C@H]2CC/C(=N\O)/C[C@@H]2C1=O

InChI

InChI=1S/C12H18N2O3/c1-2-3-6-14-11(15)9-5-4-8(13-17)7-10(9)12(14)16/h9-10,17H,2-7H2,1H3/b13-8+/t9-,10-/m0/s1