N-[2-(3,4-dihydro-2H-chromen-8-yloxy)ethyl]-2-(4-methoxy-3-methylsulfanyl-phenyl)ethanamine

Systemtic Name: N-[2-(3,4-dihydro-2H-chromen-8-yloxy)ethyl]-2-(4-methoxy-3-methylsulfanyl-phenyl)ethanamine Openeye Name: N-(2-chroman-8-yloxyethyl)-2-(4-methoxy-3-methylsulfanyl-phenyl)ethanamine CAS Name: N-[2-(3,4-dihydro-2H-1-benzopyran-8-yloxy)ethyl]-2-[4-methoxy-3-(methylthio)phenyl]ethanamine IUPAC Name: N-[2-(3,4-dihydro-2H-chromen-8-yloxy)ethyl]-2-(4-methoxy-3-methylsulfanylphenyl)ethanamine Traditional Name: 2-chroman-8-yloxyethyl-[2-[4-methoxy-3-(methylthio)phenyl]ethyl]amine Formula: C21H27NO3S MolecularWeight: 373.50898

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCCOC2=CC=CC3=C2OCCC3)SC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCCOC2=CC=CC3=C2OCCC3)SC

InChI

InChI=1S/C21H27NO3S/c1-23-18-9-8-16(15-20(18)26-2)10-11-22-12-14-24-19-7-3-5-17-6-4-13-25-21(17)19/h3,5,7-9,15,22H,4,6,10-14H2,1-2H3