4-[oxidanyl-(6-phenethylpiperidin-2-yl)methyl]benzene-1,2-diol

Systemtic Name: 4-[oxidanyl-(6-phenethylpiperidin-2-yl)methyl]benzene-1,2-diol Openeye Name: 4-[hydroxy-(6-phenethyl-2-piperidyl)methyl]benzene-1,2-diol CAS Name: 4-[hydroxy-(6-phenethyl-2-piperidinyl)methyl]benzene-1,2-diol IUPAC Name: 4-[hydroxy-(6-phenethylpiperidin-2-yl)methyl]benzene-1,2-diol Traditional Name: 4-[hydroxy-(6-phenethyl-2-piperidyl)methyl]pyrocatechol Formula: C20H25NO3 MolecularWeight: 327.4174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC(C1)C(C2=CC(=C(C=C2)O)O)O)CCC3=CC=CC=C3

Isomeric SMILES

C1CC(NC(C1)C(C2=CC(=C(C=C2)O)O)O)CCC3=CC=CC=C3

InChI

InChI=1S/C20H25NO3/c22-18-12-10-15(13-19(18)23)20(24)17-8-4-7-16(21-17)11-9-14-5-2-1-3-6-14/h1-3,5-6,10,12-13,16-17,20-24H,4,7-9,11H2