N-butyl-5-(4-chloranyl-3-methyl-phenoxy)pentan-1-amine

Systemtic Name: N-butyl-5-(4-chloranyl-3-methyl-phenoxy)pentan-1-amine Openeye Name: N-butyl-5-(4-chloro-3-methyl-phenoxy)pentan-1-amine CAS Name: N-butyl-5-(4-chloro-3-methylphenoxy)-1-pentanamine IUPAC Name: N-butyl-5-(4-chloro-3-methylphenoxy)pentan-1-amine Traditional Name: butyl-[5-(4-chloro-3-methyl-phenoxy)pentyl]amine Formula: C16H26ClNO MolecularWeight: 283.83674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCCCCCOC1=CC(=C(C=C1)Cl)C

Isomeric SMILES

CCCCNCCCCCOC1=CC(=C(C=C1)Cl)C

InChI

InChI=1S/C16H26ClNO/c1-3-4-10-18-11-6-5-7-12-19-15-8-9-16(17)14(2)13-15/h8-9,13,18H,3-7,10-12H2,1-2H3