N-(2,6-dimethylheptan-4-yl)-3-ethynyl-aniline

Systemtic Name: N-(2,6-dimethylheptan-4-yl)-3-ethynyl-aniline Openeye Name: 3-ethynyl-N-(1-isobutyl-3-methyl-butyl)aniline CAS Name: N-(2,6-dimethylheptan-4-yl)-3-ethynylaniline IUPAC Name: N-(2,6-dimethylheptan-4-yl)-3-ethynylaniline Traditional Name: (3-ethynylphenyl)-(1-isobutyl-3-methyl-butyl)amine Formula: C17H25N MolecularWeight: 243.3871

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(C)C)NC1=CC=CC(=C1)C#C

Isomeric SMILES

CC(C)CC(CC(C)C)NC1=CC=CC(=C1)C#C

InChI

InChI=1S/C17H25N/c1-6-15-8-7-9-16(12-15)18-17(10-13(2)3)11-14(4)5/h1,7-9,12-14,17-18H,10-11H2,2-5H3