5-(2-methyloctan-2-yl)-2-(1-prop-2-ynylpiperidin-3-yl)phenol

Systemtic Name: 5-(2-methyloctan-2-yl)-2-(1-prop-2-ynylpiperidin-3-yl)phenol Openeye Name: 5-(1,1-dimethylheptyl)-2-(1-prop-2-ynyl-3-piperidyl)phenol CAS Name: 5-(2-methyloctan-2-yl)-2-(1-prop-2-ynyl-3-piperidinyl)phenol IUPAC Name: 5-(2-methyloctan-2-yl)-2-(1-prop-2-ynylpiperidin-3-yl)phenol Traditional Name: 5-(1,1-dimethylheptyl)-2-(1-propargyl-3-piperidyl)phenol Formula: C23H35NO MolecularWeight: 341.5301

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CCCN(C2)CC#C)O

Isomeric SMILES

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CCCN(C2)CC#C)O

InChI

InChI=1S/C23H35NO/c1-5-7-8-9-14-23(3,4)20-12-13-21(22(25)17-20)19-11-10-16-24(18-19)15-6-2/h2,12-13,17,19,25H,5,7-11,14-16,18H2,1,3-4H3