N-[(5-chloranyl-3-methoxy-2-phenylmethoxy-phenyl)methyl]-1-phenyl-butan-1-amine hydrochloride

Systemtic Name: N-[(5-chloranyl-3-methoxy-2-phenylmethoxy-phenyl)methyl]-1-phenyl-butan-1-amine hydrochloride Openeye Name: N-[(2-benzyloxy-5-chloro-3-methoxy-phenyl)methyl]-1-phenyl-butan-1-amine hydrochloride CAS Name: N-[(5-chloro-3-methoxy-2-phenylmethoxyphenyl)methyl]-1-phenyl-1-butanamine hydrochloride IUPAC Name: N-[(5-chloro-3-methoxy-2-phenylmethoxyphenyl)methyl]-1-phenylbutan-1-amine hydrochloride Traditional Name: (2-benzoxy-5-chloro-3-methoxy-benzyl)-(1-phenylbutyl)amine hydrochloride Formula: C25H29Cl2NO2 MolecularWeight: 446.40926

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NCC2=CC(=CC(=C2OCC3=CC=CC=C3)OC)Cl.Cl

Isomeric SMILES

CCCC(C1=CC=CC=C1)NCC2=CC(=CC(=C2OCC3=CC=CC=C3)OC)Cl.Cl

InChI

InChI=1S/C25H28ClNO2.ClH/c1-3-10-23(20-13-8-5-9-14-20)27-17-21-15-22(26)16-24(28-2)25(21)29-18-19-11-6-4-7-12-19;/h4-9,11-16,23,27H,3,10,17-18H2,1-2H3;1H