1-(5-chloranyl-2-ethoxy-3-methyl-phenyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol

Systemtic Name: 1-(5-chloranyl-2-ethoxy-3-methyl-phenyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol Openeye Name: 1-(5-chloro-2-ethoxy-3-methyl-phenyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol CAS Name: 1-(5-chloro-2-ethoxy-3-methylphenyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol IUPAC Name: 1-(5-chloro-2-ethoxy-3-methylphenyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol Traditional Name: 1-(5-chloro-2-ethoxy-3-methyl-phenyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol Formula: C18H20ClNO3 MolecularWeight: 333.8093

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1C2C3=CC(=C(C=C3CCN2)O)O)Cl)C

Isomeric SMILES

CCOC1=C(C=C(C=C1C2C3=CC(=C(C=C3CCN2)O)O)Cl)C

InChI

InChI=1S/C18H20ClNO3/c1-3-23-18-10(2)6-12(19)8-14(18)17-13-9-16(22)15(21)7-11(13)4-5-20-17/h6-9,17,20-22H,3-5H2,1-2H3