3-(dimethylaminomethyl)-N-heptan-2-yl-aniline

Systemtic Name: 3-(dimethylaminomethyl)-N-heptan-2-yl-aniline Openeye Name: 3-(dimethylaminomethyl)-N-(1-methylhexyl)aniline CAS Name: 3-(dimethylaminomethyl)-N-heptan-2-ylaniline IUPAC Name: 3-(dimethylaminomethyl)-N-heptan-2-ylaniline Traditional Name: dimethyl-[3-(1-methylhexylamino)benzyl]amine Formula: C16H28N2 MolecularWeight: 248.40692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC1=CC=CC(=C1)CN(C)C

Isomeric SMILES

CCCCCC(C)NC1=CC=CC(=C1)CN(C)C

InChI

InChI=1S/C16H28N2/c1-5-6-7-9-14(2)17-16-11-8-10-15(12-16)13-18(3)4/h8,10-12,14,17H,5-7,9,13H2,1-4H3