N-[(5-bromanyl-2-propoxy-phenyl)methyl]heptan-2-amine

Systemtic Name: N-[(5-bromanyl-2-propoxy-phenyl)methyl]heptan-2-amine Openeye Name: N-[(5-bromo-2-propoxy-phenyl)methyl]heptan-2-amine CAS Name: N-[(5-bromo-2-propoxyphenyl)methyl]-2-heptanamine IUPAC Name: N-[(5-bromo-2-propoxyphenyl)methyl]heptan-2-amine Traditional Name: (5-bromo-2-propoxy-benzyl)-(1-methylhexyl)amine Formula: C17H28BrNO MolecularWeight: 342.31432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NCC1=C(C=CC(=C1)Br)OCCC

Isomeric SMILES

CCCCCC(C)NCC1=C(C=CC(=C1)Br)OCCC

InChI

InChI=1S/C17H28BrNO/c1-4-6-7-8-14(3)19-13-15-12-16(18)9-10-17(15)20-11-5-2/h9-10,12,14,19H,4-8,11,13H2,1-3H3