4-(oxan-2-yloxymethyl)-3-(2-phenylethynyl)cyclohexa-1,3-dien-1-amine

Systemtic Name: 4-(oxan-2-yloxymethyl)-3-(2-phenylethynyl)cyclohexa-1,3-dien-1-amine Openeye Name: 3-(2-phenylethynyl)-4-(tetrahydropyran-2-yloxymethyl)cyclohexa-1,3-dien-1-amine CAS Name: 4-(2-oxanyloxymethyl)-3-(2-phenylethynyl)-1-cyclohexa-1,3-dienamine IUPAC Name: 4-(oxan-2-yloxymethyl)-3-(2-phenylethynyl)cyclohexa-1,3-dien-1-amine Traditional Name: [3-(2-phenylethynyl)-4-(tetrahydropyran-2-yloxymethyl)cyclohexa-1,3-dien-1-yl]amine Formula: C20H23NO2 MolecularWeight: 309.40212

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OCC2=C(C=C(CC2)N)C#CC3=CC=CC=C3

Isomeric SMILES

C1CCOC(C1)OCC2=C(C=C(CC2)N)C#CC3=CC=CC=C3

InChI

InChI=1S/C20H23NO2/c21-19-12-11-18(15-23-20-8-4-5-13-22-20)17(14-19)10-9-16-6-2-1-3-7-16/h1-3,6-7,14,20H,4-5,8,11-13,15,21H2