4-[2-[1-(3-methoxyphenyl)propan-2-ylamino]-1-oxidanyl-ethyl]benzene-1,2-diol chloride

Systemtic Name: 4-[2-[1-(3-methoxyphenyl)propan-2-ylamino]-1-oxidanyl-ethyl]benzene-1,2-diol chloride Openeye Name: 4-[1-hydroxy-2-[[2-(3-methoxyphenyl)-1-methyl-ethyl]amino]ethyl]benzene-1,2-diol chloride CAS Name: 4-[1-hydroxy-2-[1-(3-methoxyphenyl)propan-2-ylamino]ethyl]benzene-1,2-diol chloride IUPAC Name: 4-[1-hydroxy-2-[1-(3-methoxyphenyl)propan-2-ylamino]ethyl]benzene-1,2-diol chloride Traditional Name: 4-[1-hydroxy-2-[[2-(3-methoxyphenyl)-1-methyl-ethyl]amino]ethyl]pyrocatechol chloride Formula: C18H23ClNO4- MolecularWeight: 352.83252

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=CC=C1)OC)NCC(C2=CC(=C(C=C2)O)O)O.[Cl-]

Isomeric SMILES

CC(CC1=CC(=CC=C1)OC)NCC(C2=CC(=C(C=C2)O)O)O.[Cl-]

InChI

InChI=1S/C18H23NO4.ClH/c1-12(8-13-4-3-5-15(9-13)23-2)19-11-18(22)14-6-7-16(20)17(21)10-14;/h3-7,9-10,12,18-22H,8,11H2,1-2H3;1H/p-1