7-[3-(2-chloranyl-6-ethyl-phenyl)phenoxy]heptan-1-amine

Systemtic Name: 7-[3-(2-chloranyl-6-ethyl-phenyl)phenoxy]heptan-1-amine Openeye Name: 7-[3-(2-chloro-6-ethyl-phenyl)phenoxy]heptan-1-amine CAS Name: 7-[3-(2-chloro-6-ethylphenyl)phenoxy]-1-heptanamine IUPAC Name: 7-[3-(2-chloro-6-ethylphenyl)phenoxy]heptan-1-amine Traditional Name: 7-[3-(2-chloro-6-ethyl-phenyl)phenoxy]heptylamine Formula: C21H28ClNO MolecularWeight: 345.90612

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)Cl)C2=CC(=CC=C2)OCCCCCCCN

Isomeric SMILES

CCC1=C(C(=CC=C1)Cl)C2=CC(=CC=C2)OCCCCCCCN

InChI

InChI=1S/C21H28ClNO/c1-2-17-10-9-13-20(22)21(17)18-11-8-12-19(16-18)24-15-7-5-3-4-6-14-23/h8-13,16H,2-7,14-15,23H2,1H3