N-[(3-bromanyl-4-butoxy-5-methoxy-phenyl)methyl]-2-phenyl-ethanamine hydrochloride

Systemtic Name: N-[(3-bromanyl-4-butoxy-5-methoxy-phenyl)methyl]-2-phenyl-ethanamine hydrochloride Openeye Name: N-[(3-bromo-4-butoxy-5-methoxy-phenyl)methyl]-2-phenyl-ethanamine hydrochloride CAS Name: N-[(3-bromo-4-butoxy-5-methoxyphenyl)methyl]-2-phenylethanamine hydrochloride IUPAC Name: N-[(3-bromo-4-butoxy-5-methoxyphenyl)methyl]-2-phenylethanamine hydrochloride Traditional Name: (3-bromo-4-butoxy-5-methoxy-benzyl)-phenethyl-amine hydrochloride Formula: C20H27BrClNO2 MolecularWeight: 428.79088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Br)CNCCC2=CC=CC=C2)OC.Cl

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Br)CNCCC2=CC=CC=C2)OC.Cl

InChI

InChI=1S/C20H26BrNO2.ClH/c1-3-4-12-24-20-18(21)13-17(14-19(20)23-2)15-22-11-10-16-8-6-5-7-9-16;/h5-9,13-14,22H,3-4,10-12,15H2,1-2H3;1H