3-[[1-(4-hydroxyphenyl)propan-2-ylamino]methyl]-2,4-dihydro-1,5-benzodioxepin-3-ol

Systemtic Name: 3-[[1-(4-hydroxyphenyl)propan-2-ylamino]methyl]-2,4-dihydro-1,5-benzodioxepin-3-ol Openeye Name: 3-[[[2-(4-hydroxyphenyl)-1-methyl-ethyl]amino]methyl]-2,4-dihydro-1,5-benzodioxepin-3-ol CAS Name: 3-[[1-(4-hydroxyphenyl)propan-2-ylamino]methyl]-2,4-dihydro-1,5-benzodioxepin-3-ol IUPAC Name: 3-[[1-(4-hydroxyphenyl)propan-2-ylamino]methyl]-2,4-dihydro-1,5-benzodioxepin-3-ol Traditional Name: 3-[[[2-(4-hydroxyphenyl)-1-methyl-ethyl]amino]methyl]-2,4-dihydro-1,5-benzodioxepin-3-ol Formula: C19H23NO4 MolecularWeight: 329.39022

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)O)NCC2(COC3=CC=CC=C3OC2)O

Isomeric SMILES

CC(CC1=CC=C(C=C1)O)NCC2(COC3=CC=CC=C3OC2)O

InChI

InChI=1S/C19H23NO4/c1-14(10-15-6-8-16(21)9-7-15)20-11-19(22)12-23-17-4-2-3-5-18(17)24-13-19/h2-9,14,20-22H,10-13H2,1H3