(8S,8aR)-4-butyl-8-methyl-2,6,8,8a-tetrahydrofuro[2,3-c]oxepine

Systemtic Name: (8S,8aR)-4-butyl-8-methyl-2,6,8,8a-tetrahydrofuro[2,3-c]oxepine Openeye Name: (8S,8aR)-4-butyl-8-methyl-2,6,8,8a-tetrahydrofuro[2,3-c]oxepine CAS Name: (8S,8aR)-4-butyl-8-methyl-2,6,8,8a-tetrahydrofuro[2,3-c]oxepin IUPAC Name: (8S,8aR)-4-butyl-8-methyl-2,6,8,8a-tetrahydrofuro[2,3-c]oxepine Traditional Name: (8S,8aR)-4-butyl-8-methyl-2,6,8,8a-tetrahydrofuro[2,3-c]oxepin Formula: C13H20O2 MolecularWeight: 208.2967

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CCOC(C2C1=CCO2)C

Isomeric SMILES

CCCCC1=CCO[C@H]([C@H]2C1=CCO2)C

InChI

InChI=1S/C13H20O2/c1-3-4-5-11-6-8-14-10(2)13-12(11)7-9-15-13/h6-7,10,13H,3-5,8-9H2,1-2H3/t10-,13-/m0/s1