ethyl 1-(4-prop-2-ynoxyphenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(4-prop-2-ynoxyphenyl)carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(4-prop-2-ynoxybenzoyl)piperidine-4-carboxylate CAS Name: 1-[oxo-(4-prop-2-ynoxyphenyl)methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-prop-2-ynoxybenzoyl)piperidine-4-carboxylate Traditional Name: 1-(4-propargyloxybenzoyl)isonipecotic acid ethyl ester Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)OCC#C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)OCC#C

InChI

InChI=1S/C18H21NO4/c1-3-13-23-16-7-5-14(6-8-16)17(20)19-11-9-15(10-12-19)18(21)22-4-2/h1,5-8,15H,4,9-13H2,2H3