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

Systemtic Name: N-[[3-chloranyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-2-methoxy-ethanamine Openeye Name: N-[[3-chloro-5-methoxy-4-(2-thienylmethoxy)phenyl]methyl]-2-methoxy-ethanamine CAS Name: N-[[3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-2-methoxyethanamine IUPAC Name: N-[[3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-2-methoxyethanamine Traditional Name: [3-chloro-5-methoxy-4-(2-thenyloxy)benzyl]-(2-methoxyethyl)amine Formula: C16H20ClNO3S MolecularWeight: 341.8529

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Descriptors Computed from Structure

Canonical SMILES:

COCCNCC1=CC(=C(C(=C1)Cl)OCC2=CC=CS2)OC

Isomeric SMILES

COCCNCC1=CC(=C(C(=C1)Cl)OCC2=CC=CS2)OC

InChI

InChI=1S/C16H20ClNO3S/c1-19-6-5-18-10-12-8-14(17)16(15(9-12)20-2)21-11-13-4-3-7-22-13/h3-4,7-9,18H,5-6,10-11H2,1-2H3