(1S)-1-[[3,5-bis(chloranyl)-4-methoxy-phenyl]methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride

Systemtic Name: (1S)-1-[[3,5-bis(chloranyl)-4-methoxy-phenyl]methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride Openeye Name: (1S)-1-[(3,5-dichloro-4-methoxy-phenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride CAS Name: (1S)-1-[(3,5-dichloro-4-methoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride IUPAC Name: (1S)-1-[(3,5-dichloro-4-methoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride Traditional Name: (1S)-1-(3,5-dichloro-4-methoxy-benzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride Formula: C17H18Cl3NO3 MolecularWeight: 390.68872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Cl)CC2C3=CC(=C(C=C3CCN2)O)O)Cl.Cl

Isomeric SMILES

COC1=C(C=C(C=C1Cl)C[C@H]2C3=CC(=C(C=C3CCN2)O)O)Cl.Cl

InChI

InChI=1S/C17H17Cl2NO3.ClH/c1-23-17-12(18)4-9(5-13(17)19)6-14-11-8-16(22)15(21)7-10(11)2-3-20-14;/h4-5,7-8,14,20-22H,2-3,6H2,1H3;1H/t14-;/m0./s1