4-[2-(methylamino)-1-oxidanyl-ethyl]benzene-1,2-diol; propan-1-amine

Systemtic Name: 4-[2-(methylamino)-1-oxidanyl-ethyl]benzene-1,2-diol; propan-1-amine Openeye Name: 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol; propan-1-amine CAS Name: 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol; 1-propanamine IUPAC Name: 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol; propan-1-amine Traditional Name: 4-[1-hydroxy-2-(methylamino)ethyl]pyrocatechol; propylamine Formula: C12H22N2O3 MolecularWeight: 242.31468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN.CNCC(C1=CC(=C(C=C1)O)O)O

Isomeric SMILES

CCCN.CNCC(C1=CC(=C(C=C1)O)O)O

InChI

InChI=1S/C9H13NO3.C3H9N/c1-10-5-9(13)6-2-3-7(11)8(12)4-6;1-2-3-4/h2-4,9-13H,5H2,1H3;2-4H2,1H3