2-azanyl-5-[1-[(2-methyl-1-oxidanyl-propan-2-yl)amino]-2-oxidanyl-ethyl]benzenecarbonitrile

Systemtic Name: 2-azanyl-5-[1-[(2-methyl-1-oxidanyl-propan-2-yl)amino]-2-oxidanyl-ethyl]benzenecarbonitrile Openeye Name: 2-amino-5-[2-hydroxy-1-[(2-hydroxy-1,1-dimethyl-ethyl)amino]ethyl]benzonitrile CAS Name: 2-amino-5-[2-hydroxy-1-[(1-hydroxy-2-methylpropan-2-yl)amino]ethyl]benzonitrile IUPAC Name: 2-amino-5-[2-hydroxy-1-[(1-hydroxy-2-methylpropan-2-yl)amino]ethyl]benzonitrile Traditional Name: 2-amino-5-[2-hydroxy-1-[(2-hydroxy-1,1-dimethyl-ethyl)amino]ethyl]benzonitrile Formula: C13H19N3O2 MolecularWeight: 249.30886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)NC(CO)C1=CC(=C(C=C1)N)C#N

Isomeric SMILES

CC(C)(CO)NC(CO)C1=CC(=C(C=C1)N)C#N

InChI

InChI=1S/C13H19N3O2/c1-13(2,8-18)16-12(7-17)9-3-4-11(15)10(5-9)6-14/h3-5,12,16-18H,7-8,15H2,1-2H3