methyl 2-ethoxy-3-pent-3-ynyl-azepane-1-carboxylate

Systemtic Name: methyl 2-ethoxy-3-pent-3-ynyl-azepane-1-carboxylate Openeye Name: methyl 2-ethoxy-3-pent-3-ynyl-azepane-1-carboxylate CAS Name: 2-ethoxy-3-pent-3-ynyl-1-azepanecarboxylic acid methyl ester IUPAC Name: methyl 2-ethoxy-3-pent-3-ynylazepane-1-carboxylate Traditional Name: 2-ethoxy-3-pent-3-ynyl-azepane-1-carboxylic acid methyl ester Formula: C15H25NO3 MolecularWeight: 267.3639

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1C(CCCCN1C(=O)OC)CCC#CC

Isomeric SMILES

CCOC1C(CCCCN1C(=O)OC)CCC#CC

InChI

InChI=1S/C15H25NO3/c1-4-6-7-10-13-11-8-9-12-16(15(17)18-3)14(13)19-5-2/h13-14H,5,7-12H2,1-3H3