N-tert-butyl-5-(4-chloranyl-2-phenyl-phenoxy)pentan-1-amine

Systemtic Name: N-tert-butyl-5-(4-chloranyl-2-phenyl-phenoxy)pentan-1-amine Openeye Name: N-tert-butyl-5-(4-chloro-2-phenyl-phenoxy)pentan-1-amine CAS Name: N-tert-butyl-5-(4-chloro-2-phenylphenoxy)-1-pentanamine IUPAC Name: N-tert-butyl-5-(4-chloro-2-phenylphenoxy)pentan-1-amine Traditional Name: tert-butyl-[5-(4-chloro-2-phenyl-phenoxy)pentyl]amine Formula: C21H28ClNO MolecularWeight: 345.90612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCCCCCOC1=C(C=C(C=C1)Cl)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)NCCCCCOC1=C(C=C(C=C1)Cl)C2=CC=CC=C2

InChI

InChI=1S/C21H28ClNO/c1-21(2,3)23-14-8-5-9-15-24-20-13-12-18(22)16-19(20)17-10-6-4-7-11-17/h4,6-7,10-13,16,23H,5,8-9,14-15H2,1-3H3