N-[[3-chloranyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]octan-1-amine

Systemtic Name: N-[[3-chloranyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]octan-1-amine Openeye Name: N-[[3-chloro-5-methoxy-4-(2-thienylmethoxy)phenyl]methyl]octan-1-amine CAS Name: N-[[3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-1-octanamine IUPAC Name: N-[[3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]octan-1-amine Traditional Name: [3-chloro-5-methoxy-4-(2-thenyloxy)benzyl]-octyl-amine Formula: C21H30ClNO2S MolecularWeight: 395.9864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNCC1=CC(=C(C(=C1)Cl)OCC2=CC=CS2)OC

Isomeric SMILES

CCCCCCCCNCC1=CC(=C(C(=C1)Cl)OCC2=CC=CS2)OC

InChI

InChI=1S/C21H30ClNO2S/c1-3-4-5-6-7-8-11-23-15-17-13-19(22)21(20(14-17)24-2)25-16-18-10-9-12-26-18/h9-10,12-14,23H,3-8,11,15-16H2,1-2H3