3-[[(2,2-dimethyl-1,3-benzodioxol-5-yl)amino]methyl]phenol

Systemtic Name: 3-[[(2,2-dimethyl-1,3-benzodioxol-5-yl)amino]methyl]phenol Openeye Name: 3-[[(2,2-dimethyl-1,3-benzodioxol-5-yl)amino]methyl]phenol CAS Name: 3-[[(2,2-dimethyl-1,3-benzodioxol-5-yl)amino]methyl]phenol IUPAC Name: 3-[[(2,2-dimethyl-1,3-benzodioxol-5-yl)amino]methyl]phenol Traditional Name: 3-[[(2,2-dimethyl-1,3-benzodioxol-5-yl)amino]methyl]phenol Formula: C16H17NO3 MolecularWeight: 271.31108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2=C(O1)C=C(C=C2)NCC3=CC(=CC=C3)O)C

Isomeric SMILES

CC1(OC2=C(O1)C=C(C=C2)NCC3=CC(=CC=C3)O)C

InChI

InChI=1S/C16H17NO3/c1-16(2)19-14-7-6-12(9-15(14)20-16)17-10-11-4-3-5-13(18)8-11/h3-9,17-18H,10H2,1-2H3