methyl 5-[3-[(2-oxidanyl-2-phenyl-ethyl)amino]propyl]thiophene-2-carboxylate

Systemtic Name: methyl 5-[3-[(2-oxidanyl-2-phenyl-ethyl)amino]propyl]thiophene-2-carboxylate Openeye Name: methyl 5-[3-[(2-hydroxy-2-phenyl-ethyl)amino]propyl]thiophene-2-carboxylate CAS Name: 5-[3-[(2-hydroxy-2-phenylethyl)amino]propyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[3-[(2-hydroxy-2-phenylethyl)amino]propyl]thiophene-2-carboxylate Traditional Name: 5-[3-[(2-hydroxy-2-phenyl-ethyl)amino]propyl]thiophene-2-carboxylic acid methyl ester Formula: C17H21NO3S MolecularWeight: 319.41854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(S1)CCCNCC(C2=CC=CC=C2)O

Isomeric SMILES

COC(=O)C1=CC=C(S1)CCCNCC(C2=CC=CC=C2)O

InChI

InChI=1S/C17H21NO3S/c1-21-17(20)16-10-9-14(22-16)8-5-11-18-12-15(19)13-6-3-2-4-7-13/h2-4,6-7,9-10,15,18-19H,5,8,11-12H2,1H3