2-ethyl-1-methyl-piperidine; 7-oxabicyclo[2.2.1]hepta-1,3,5-trien-3-yl pentanoate

Systemtic Name: 2-ethyl-1-methyl-piperidine; 7-oxabicyclo[2.2.1]hepta-1,3,5-trien-3-yl pentanoate Openeye Name: 2-ethyl-1-methyl-piperidine; 7-oxabicyclo[2.2.1]hepta-1,3,5-trien-3-yl pentanoate CAS Name: 2-ethyl-1-methylpiperidine; pentanoic acid 7-oxabicyclo[2.2.1]hepta-1,3,5-trien-3-yl ester IUPAC Name: 2-ethyl-1-methylpiperidine; 7-oxabicyclo[2.2.1]hepta-1,3,5-trien-3-yl pentanoate Traditional Name: 2-ethyl-1-methyl-piperidine; valeric acid 7-oxabicyclo[2.2.1]hepta-1,3,5-trien-3-yl ester Formula: C19H29NO3 MolecularWeight: 319.43846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1=C2C=CC(=C1)O2.CCC1CCCCN1C

Isomeric SMILES

CCCCC(=O)OC1=C2C=CC(=C1)O2.CCC1CCCCN1C

InChI

InChI=1S/C11H12O3.C8H17N/c1-2-3-4-11(12)14-10-7-8-5-6-9(10)13-8;1-3-8-6-4-5-7-9(8)2/h5-7H,2-4H2,1H3;8H,3-7H2,1-2H3