5-ethyl-5-methyl-4-phenyl-1-piperidin-1-yl-hept-2-yn-4-ol

Systemtic Name: 5-ethyl-5-methyl-4-phenyl-1-piperidin-1-yl-hept-2-yn-4-ol Openeye Name: 5-ethyl-5-methyl-4-phenyl-1-(1-piperidyl)hept-2-yn-4-ol CAS Name: 5-ethyl-5-methyl-4-phenyl-1-(1-piperidinyl)-2-heptyn-4-ol IUPAC Name: 5-ethyl-5-methyl-4-phenyl-1-piperidin-1-ylhept-2-yn-4-ol Traditional Name: 5-ethyl-5-methyl-4-phenyl-1-piperidino-hept-2-yn-4-ol Formula: C21H31NO MolecularWeight: 313.47694

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC)C(C#CCN1CCCCC1)(C2=CC=CC=C2)O

Isomeric SMILES

CCC(C)(CC)C(C#CCN1CCCCC1)(C2=CC=CC=C2)O

InChI

InChI=1S/C21H31NO/c1-4-20(3,5-2)21(23,19-13-8-6-9-14-19)15-12-18-22-16-10-7-11-17-22/h6,8-9,13-14,23H,4-5,7,10-11,16-18H2,1-3H3