3-iodanyl-N-octan-2-yl-aniline

Systemtic Name: 3-iodanyl-N-octan-2-yl-aniline Openeye Name: 3-iodo-N-(1-methylheptyl)aniline CAS Name: 3-iodo-N-octan-2-ylaniline IUPAC Name: 3-iodo-N-octan-2-ylaniline Traditional Name: (3-iodophenyl)-(1-methylheptyl)amine Formula: C14H22IN MolecularWeight: 331.23565

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)NC1=CC(=CC=C1)I

Isomeric SMILES

CCCCCCC(C)NC1=CC(=CC=C1)I

InChI

InChI=1S/C14H22IN/c1-3-4-5-6-8-12(2)16-14-10-7-9-13(15)11-14/h7,9-12,16H,3-6,8H2,1-2H3