3-ethyl-4-methyl-4-phenyl-7-piperidin-1-yl-hept-5-yn-3-ol

Systemtic Name: 3-ethyl-4-methyl-4-phenyl-7-piperidin-1-yl-hept-5-yn-3-ol Openeye Name: 3-ethyl-4-methyl-4-phenyl-7-(1-piperidyl)hept-5-yn-3-ol CAS Name: 3-ethyl-4-methyl-4-phenyl-7-(1-piperidinyl)-5-heptyn-3-ol IUPAC Name: 3-ethyl-4-methyl-4-phenyl-7-piperidin-1-ylhept-5-yn-3-ol Traditional Name: 3-ethyl-4-methyl-4-phenyl-7-piperidino-hept-5-yn-3-ol Formula: C21H31NO MolecularWeight: 313.47694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H31NO/c1-4-21(23,5-2)20(3,19-13-8-6-9-14-19)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