2-[2-(4-chloranyl-1,3-benzodioxol-5-yl)ethylamino]-1-(4-methoxyphenyl)ethanol

Systemtic Name: 2-[2-(4-chloranyl-1,3-benzodioxol-5-yl)ethylamino]-1-(4-methoxyphenyl)ethanol Openeye Name: 2-[2-(4-chloro-1,3-benzodioxol-5-yl)ethylamino]-1-(4-methoxyphenyl)ethanol CAS Name: 2-[2-(4-chloro-1,3-benzodioxol-5-yl)ethylamino]-1-(4-methoxyphenyl)ethanol IUPAC Name: 2-[2-(4-chloro-1,3-benzodioxol-5-yl)ethylamino]-1-(4-methoxyphenyl)ethanol Traditional Name: 2-[2-(4-chloro-1,3-benzodioxol-5-yl)ethylamino]-1-(4-methoxyphenyl)ethanol Formula: C18H20ClNO4 MolecularWeight: 349.8087

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNCCC2=C(C3=C(C=C2)OCO3)Cl)O

Isomeric SMILES

COC1=CC=C(C=C1)C(CNCCC2=C(C3=C(C=C2)OCO3)Cl)O

InChI

InChI=1S/C18H20ClNO4/c1-22-14-5-2-12(3-6-14)15(21)10-20-9-8-13-4-7-16-18(17(13)19)24-11-23-16/h2-7,15,20-21H,8-11H2,1H3