4-[5-methoxy-2-(2-phenylethynyl)phenyl]-N,N-dimethyl-butan-2-amine

Systemtic Name: 4-[5-methoxy-2-(2-phenylethynyl)phenyl]-N,N-dimethyl-butan-2-amine Openeye Name: 4-[5-methoxy-2-(2-phenylethynyl)phenyl]-N,N-dimethyl-butan-2-amine CAS Name: 4-[5-methoxy-2-(2-phenylethynyl)phenyl]-N,N-dimethyl-2-butanamine IUPAC Name: 4-[5-methoxy-2-(2-phenylethynyl)phenyl]-N,N-dimethylbutan-2-amine Traditional Name: [3-[5-methoxy-2-(2-phenylethynyl)phenyl]-1-methyl-propyl]-dimethyl-amine Formula: C21H25NO MolecularWeight: 307.4293

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=C(C=CC(=C1)OC)C#CC2=CC=CC=C2)N(C)C

Isomeric SMILES

CC(CCC1=C(C=CC(=C1)OC)C#CC2=CC=CC=C2)N(C)C

InChI

InChI=1S/C21H25NO/c1-17(22(2)3)10-12-20-16-21(23-4)15-14-19(20)13-11-18-8-6-5-7-9-18/h5-9,14-17H,10,12H2,1-4H3