N-[(3-bromanyl-4,5-diethoxy-phenyl)methyl]-2-(3,4-dimethoxyphenyl)ethanamine

Systemtic Name: N-[(3-bromanyl-4,5-diethoxy-phenyl)methyl]-2-(3,4-dimethoxyphenyl)ethanamine Openeye Name: N-[(3-bromo-4,5-diethoxy-phenyl)methyl]-2-(3,4-dimethoxyphenyl)ethanamine CAS Name: N-[(3-bromo-4,5-diethoxyphenyl)methyl]-2-(3,4-dimethoxyphenyl)ethanamine IUPAC Name: N-[(3-bromo-4,5-diethoxyphenyl)methyl]-2-(3,4-dimethoxyphenyl)ethanamine Traditional Name: (3-bromo-4,5-diethoxy-benzyl)-homoveratryl-amine Formula: C21H28BrNO4 MolecularWeight: 438.35532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CNCCC2=CC(=C(C=C2)OC)OC)Br)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CNCCC2=CC(=C(C=C2)OC)OC)Br)OCC

InChI

InChI=1S/C21H28BrNO4/c1-5-26-20-13-16(11-17(22)21(20)27-6-2)14-23-10-9-15-7-8-18(24-3)19(12-15)25-4/h7-8,11-13,23H,5-6,9-10,14H2,1-4H3