4-[[4-(2,4,4-trimethylpentan-2-yl)phenoxy]methyl]aniline

Systemtic Name: 4-[[4-(2,4,4-trimethylpentan-2-yl)phenoxy]methyl]aniline Openeye Name: 4-[[4-(1,1,3,3-tetramethylbutyl)phenoxy]methyl]aniline CAS Name: 4-[[4-(2,4,4-trimethylpentan-2-yl)phenoxy]methyl]aniline IUPAC Name: 4-[[4-(2,4,4-trimethylpentan-2-yl)phenoxy]methyl]aniline Traditional Name: [4-[[4-(1,1,3,3-tetramethylbutyl)phenoxy]methyl]phenyl]amine Formula: C21H29NO MolecularWeight: 311.46106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCC2=CC=C(C=C2)N

Isomeric SMILES

CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCC2=CC=C(C=C2)N

InChI

InChI=1S/C21H29NO/c1-20(2,3)15-21(4,5)17-8-12-19(13-9-17)23-14-16-6-10-18(22)11-7-16/h6-13H,14-15,22H2,1-5H3