10-[[[2-methyl-1,3-bis(oxidanyl)propan-2-yl]amino]methyl]anthracene-9-carbonitrile hydrochloride

Systemtic Name: 10-[[[2-methyl-1,3-bis(oxidanyl)propan-2-yl]amino]methyl]anthracene-9-carbonitrile hydrochloride Openeye Name: 10-[[[2-hydroxy-1-(hydroxymethyl)-1-methyl-ethyl]amino]methyl]anthracene-9-carbonitrile hydrochloride CAS Name: 10-[[(1,3-dihydroxy-2-methylpropan-2-yl)amino]methyl]-9-anthracenecarbonitrile hydrochloride IUPAC Name: 10-[[(1,3-dihydroxy-2-methylpropan-2-yl)amino]methyl]anthracene-9-carbonitrile hydrochloride Traditional Name: 10-[[(2-hydroxy-1-methyl-1-methylol-ethyl)amino]methyl]anthracene-9-carbonitrile hydrochloride Formula: C20H21ClN2O2 MolecularWeight: 356.84594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(CO)NCC1=C2C=CC=CC2=C(C3=CC=CC=C31)C#N.Cl

Isomeric SMILES

CC(CO)(CO)NCC1=C2C=CC=CC2=C(C3=CC=CC=C31)C#N.Cl

InChI

InChI=1S/C20H20N2O2.ClH/c1-20(12-23,13-24)22-11-19-16-8-4-2-6-14(16)18(10-21)15-7-3-5-9-17(15)19;/h2-9,22-24H,11-13H2,1H3;1H