4-bromanyl-3-methyl-N-pentan-2-yl-aniline

Systemtic Name: 4-bromanyl-3-methyl-N-pentan-2-yl-aniline Openeye Name: 4-bromo-3-methyl-N-(1-methylbutyl)aniline CAS Name: 4-bromo-3-methyl-N-pentan-2-ylaniline IUPAC Name: 4-bromo-3-methyl-N-pentan-2-ylaniline Traditional Name: (4-bromo-3-methyl-phenyl)-(1-methylbutyl)amine Formula: C12H18BrN MolecularWeight: 256.18202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18BrN/c1-4-5-10(3)14-11-6-7-12(13)9(2)8-11/h6-8,10,14H,4-5H2,1-3H3