2-ethyl-3,6-dimethyl-phenol; N-ethyl-3-phenyl-propan-1-amine

Systemtic Name: 2-ethyl-3,6-dimethyl-phenol; N-ethyl-3-phenyl-propan-1-amine Openeye Name: 2-ethyl-3,6-dimethyl-phenol; N-ethyl-3-phenyl-propan-1-amine CAS Name: 2-ethyl-3,6-dimethylphenol; N-ethyl-3-phenyl-1-propanamine IUPAC Name: 2-ethyl-3,6-dimethylphenol; N-ethyl-3-phenylpropan-1-amine Traditional Name: 2-ethyl-3,6-dimethyl-phenol; ethyl(3-phenylpropyl)amine Formula: C21H31NO MolecularWeight: 313.47694

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1O)C)C.CCNCCCC1=CC=CC=C1

Isomeric SMILES

CCC1=C(C=CC(=C1O)C)C.CCNCCCC1=CC=CC=C1

InChI

InChI=1S/C11H17N.C10H14O/c1-2-12-10-6-9-11-7-4-3-5-8-11;1-4-9-7(2)5-6-8(3)10(9)11/h3-5,7-8,12H,2,6,9-10H2,1H3;5-6,11H,4H2,1-3H3