N-[(3-chloranyl-5-ethoxy-4-phenylmethoxy-phenyl)methyl]ethanamine hydrochloride

Systemtic Name: N-[(3-chloranyl-5-ethoxy-4-phenylmethoxy-phenyl)methyl]ethanamine hydrochloride Openeye Name: N-[(4-benzyloxy-3-chloro-5-ethoxy-phenyl)methyl]ethanamine hydrochloride CAS Name: N-[(3-chloro-5-ethoxy-4-phenylmethoxyphenyl)methyl]ethanamine hydrochloride IUPAC Name: N-[(3-chloro-5-ethoxy-4-phenylmethoxyphenyl)methyl]ethanamine hydrochloride Traditional Name: (4-benzoxy-3-chloro-5-ethoxy-benzyl)-ethyl-amine hydrochloride Formula: C18H23Cl2NO2 MolecularWeight: 356.28672

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=CC(=C(C(=C1)Cl)OCC2=CC=CC=C2)OCC.Cl

Isomeric SMILES

CCNCC1=CC(=C(C(=C1)Cl)OCC2=CC=CC=C2)OCC.Cl

InChI

InChI=1S/C18H22ClNO2.ClH/c1-3-20-12-15-10-16(19)18(17(11-15)21-4-2)22-13-14-8-6-5-7-9-14;/h5-11,20H,3-4,12-13H2,1-2H3;1H