iodanylmethane; 2-(4-phenylphenyl)-5-piperidin-1-yl-hept-3-yn-2-ol

Systemtic Name: iodanylmethane; 2-(4-phenylphenyl)-5-piperidin-1-yl-hept-3-yn-2-ol Openeye Name: iodomethane; 2-(4-phenylphenyl)-5-(1-piperidyl)hept-3-yn-2-ol CAS Name: iodomethane; 2-(4-phenylphenyl)-5-(1-piperidinyl)-3-heptyn-2-ol IUPAC Name: iodomethane; 2-(4-phenylphenyl)-5-piperidin-1-ylhept-3-yn-2-ol Traditional Name: iodomethane; 2-(4-phenylphenyl)-5-piperidino-hept-3-yn-2-ol Formula: C25H32INO MolecularWeight: 489.43215

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C#CC(C)(C1=CC=C(C=C1)C2=CC=CC=C2)O)N3CCCCC3.CI

Isomeric SMILES

CCC(C#CC(C)(C1=CC=C(C=C1)C2=CC=CC=C2)O)N3CCCCC3.CI

InChI

InChI=1S/C24H29NO.CH3I/c1-3-23(25-18-8-5-9-19-25)16-17-24(2,26)22-14-12-21(13-15-22)20-10-6-4-7-11-20;1-2/h4,6-7,10-15,23,26H,3,5,8-9,18-19H2,1-2H3;1H3