N-[[4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl]-2-(3,4-dimethoxyphenyl)ethanamine

Systemtic Name: N-[[4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl]-2-(3,4-dimethoxyphenyl)ethanamine Openeye Name: N-[[4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl]-2-(3,4-dimethoxyphenyl)ethanamine CAS Name: N-[[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methyl]-2-(3,4-dimethoxyphenyl)ethanamine IUPAC Name: N-[[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methyl]-2-(3,4-dimethoxyphenyl)ethanamine Traditional Name: [4-(4-chlorobenzyl)oxy-3-methoxy-benzyl]-homoveratryl-amine Formula: C25H28ClNO4 MolecularWeight: 441.94712

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCC2=CC(=C(C=C2)OCC3=CC=C(C=C3)Cl)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCC2=CC(=C(C=C2)OCC3=CC=C(C=C3)Cl)OC)OC

InChI

InChI=1S/C25H28ClNO4/c1-28-22-10-6-18(14-24(22)29-2)12-13-27-16-20-7-11-23(25(15-20)30-3)31-17-19-4-8-21(26)9-5-19/h4-11,14-15,27H,12-13,16-17H2,1-3H3