5-bromanyl-N-heptan-2-yl-2-methyl-aniline

Systemtic Name: 5-bromanyl-N-heptan-2-yl-2-methyl-aniline Openeye Name: 5-bromo-2-methyl-N-(1-methylhexyl)aniline CAS Name: 5-bromo-N-heptan-2-yl-2-methylaniline IUPAC Name: 5-bromo-N-heptan-2-yl-2-methylaniline Traditional Name: (5-bromo-2-methyl-phenyl)-(1-methylhexyl)amine Formula: C14H22BrN MolecularWeight: 284.23518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22BrN/c1-4-5-6-7-12(3)16-14-10-13(15)9-8-11(14)2/h8-10,12,16H,4-7H2,1-3H3