1-[(4-prop-2-enoxyphenyl)sulfanylmethyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol

Systemtic Name: 1-[(4-prop-2-enoxyphenyl)sulfanylmethyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol Openeye Name: 1-[(4-allyloxyphenyl)sulfanylmethyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol CAS Name: 1-[[(4-prop-2-enoxyphenyl)thio]methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol IUPAC Name: 1-[(4-prop-2-enoxyphenyl)sulfanylmethyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol Traditional Name: 1-[[(4-allyloxyphenyl)thio]methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=C(C=C1)SCC2C3=CC(=C(C=C3CCN2)O)O

Isomeric SMILES

C=CCOC1=CC=C(C=C1)SCC2C3=CC(=C(C=C3CCN2)O)O

InChI

InChI=1S/C19H21NO3S/c1-2-9-23-14-3-5-15(6-4-14)24-12-17-16-11-19(22)18(21)10-13(16)7-8-20-17/h2-6,10-11,17,20-22H,1,7-9,12H2