2-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-(naphthalen-1-ylmethyl)amino]ethanoic acid

Systemtic Name: 2-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-(naphthalen-1-ylmethyl)amino]ethanoic acid Openeye Name: 2-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-(1-naphthylmethyl)amino]acetic acid CAS Name: 2-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-(1-naphthalenylmethyl)amino]acetic acid IUPAC Name: 2-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-(naphthalen-1-ylmethyl)amino]acetic acid Traditional Name: 2-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-(1-naphthylmethyl)amino]acetic acid Formula: C22H25NO2 MolecularWeight: 335.4394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC=CCN(CC1=CC=CC2=CC=CC=C21)CC(=O)O

Isomeric SMILES

CC(C)(C)C#C/C=C/CN(CC1=CC=CC2=CC=CC=C21)CC(=O)O

InChI

InChI=1S/C22H25NO2/c1-22(2,3)14-7-4-8-15-23(17-21(24)25)16-19-12-9-11-18-10-5-6-13-20(18)19/h4-6,8-13H,15-17H2,1-3H3,(H,24,25)/b8-4+