N-[(5-chloranyl-2-phenylmethoxy-phenyl)methyl]heptan-1-amine hydrochloride

Systemtic Name: N-[(5-chloranyl-2-phenylmethoxy-phenyl)methyl]heptan-1-amine hydrochloride Openeye Name: N-[(2-benzyloxy-5-chloro-phenyl)methyl]heptan-1-amine hydrochloride CAS Name: N-[(5-chloro-2-phenylmethoxyphenyl)methyl]-1-heptanamine hydrochloride IUPAC Name: N-[(5-chloro-2-phenylmethoxyphenyl)methyl]heptan-1-amine hydrochloride Traditional Name: (2-benzoxy-5-chloro-benzyl)-heptyl-amine hydrochloride Formula: C21H29Cl2NO MolecularWeight: 382.36706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNCC1=C(C=CC(=C1)Cl)OCC2=CC=CC=C2.Cl

Isomeric SMILES

CCCCCCCNCC1=C(C=CC(=C1)Cl)OCC2=CC=CC=C2.Cl

InChI

InChI=1S/C21H28ClNO.ClH/c1-2-3-4-5-9-14-23-16-19-15-20(22)12-13-21(19)24-17-18-10-7-6-8-11-18;/h6-8,10-13,15,23H,2-5,9,14,16-17H2,1H3;1H