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

Systemtic Name: N-[[3-chloranyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-2-phenyl-ethanamine Openeye Name: N-[[3-chloro-5-methoxy-4-(2-thienylmethoxy)phenyl]methyl]-2-phenyl-ethanamine CAS Name: N-[[3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-2-phenylethanamine IUPAC Name: N-[[3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-2-phenylethanamine Traditional Name: [3-chloro-5-methoxy-4-(2-thenyloxy)benzyl]-phenethyl-amine Formula: C21H22ClNO2S MolecularWeight: 387.92288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNCCC2=CC=CC=C2)Cl)OCC3=CC=CS3

Isomeric SMILES

COC1=C(C(=CC(=C1)CNCCC2=CC=CC=C2)Cl)OCC3=CC=CS3

InChI

InChI=1S/C21H22ClNO2S/c1-24-20-13-17(14-23-10-9-16-6-3-2-4-7-16)12-19(22)21(20)25-15-18-8-5-11-26-18/h2-8,11-13,23H,9-10,14-15H2,1H3