N-[[3-chloranyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-2-(3,4-dimethoxyphenyl)ethanamine

Systemtic Name: N-[[3-chloranyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-2-(3,4-dimethoxyphenyl)ethanamine Openeye Name: N-[[3-chloro-5-methoxy-4-(2-thienylmethoxy)phenyl]methyl]-2-(3,4-dimethoxyphenyl)ethanamine CAS Name: N-[[3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-2-(3,4-dimethoxyphenyl)ethanamine IUPAC Name: N-[[3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-2-(3,4-dimethoxyphenyl)ethanamine Traditional Name: [3-chloro-5-methoxy-4-(2-thenyloxy)benzyl]-homoveratryl-amine Formula: C23H26ClNO4S MolecularWeight: 447.97484

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCC2=CC(=C(C(=C2)Cl)OCC3=CC=CS3)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCC2=CC(=C(C(=C2)Cl)OCC3=CC=CS3)OC)OC

InChI

InChI=1S/C23H26ClNO4S/c1-26-20-7-6-16(12-21(20)27-2)8-9-25-14-17-11-19(24)23(22(13-17)28-3)29-15-18-5-4-10-30-18/h4-7,10-13,25H,8-9,14-15H2,1-3H3