(3R,3aS,7aR)-3-ethoxy-2-(hydroxymethyl)-3a,4,7,7a-tetrahydro-3H-isoindol-1-one

Systemtic Name: (3R,3aS,7aR)-3-ethoxy-2-(hydroxymethyl)-3a,4,7,7a-tetrahydro-3H-isoindol-1-one Openeye Name: (3R,3aS,7aR)-3-ethoxy-2-(hydroxymethyl)-3a,4,7,7a-tetrahydro-3H-isoindol-1-one CAS Name: (3R,3aS,7aR)-3-ethoxy-2-(hydroxymethyl)-3a,4,7,7a-tetrahydro-3H-isoindol-1-one IUPAC Name: (3R,3aS,7aR)-3-ethoxy-2-(hydroxymethyl)-3a,4,7,7a-tetrahydro-3H-isoindol-1-one Traditional Name: (3R,3aS,7aR)-3-ethoxy-2-methylol-3a,4,7,7a-tetrahydro-3H-isoindol-1-one Formula: C11H17NO3 MolecularWeight: 211.25758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1C2CC=CCC2C(=O)N1CO

Isomeric SMILES

CCO[C@@H]1[C@H]2CC=CC[C@H]2C(=O)N1CO

InChI

InChI=1S/C11H17NO3/c1-2-15-11-9-6-4-3-5-8(9)10(14)12(11)7-13/h3-4,8-9,11,13H,2,5-7H2,1H3/t8-,9+,11-/m1/s1