1-cyano-1-[[1-[1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-oxidanyl-ethyl]piperidin-4-yl]methyl]-2-methyl-guanidine

Systemtic Name: 1-cyano-1-[[1-[1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-oxidanyl-ethyl]piperidin-4-yl]methyl]-2-methyl-guanidine Openeye Name: 1-cyano-1-[[1-[1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-hydroxy-ethyl]-4-piperidyl]methyl]-2-methyl-guanidine CAS Name: 1-cyano-1-[[1-[1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-hydroxyethyl]-4-piperidinyl]methyl]-2-methylguanidine IUPAC Name: 1-cyano-1-[[1-[1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-hydroxyethyl]piperidin-4-yl]methyl]-2-methylguanidine Traditional Name: 1-cyano-1-[[1-[1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-hydroxy-ethyl]-4-piperidyl]methyl]-2-methyl-guanidine Formula: C19H27N5O3 MolecularWeight: 373.44938

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(N)N(CC1CCN(CC1)C(CO)C2COC3=CC=CC=C3O2)C#N

Isomeric SMILES

CN=C(N)N(CC1CCN(CC1)C(CO)C2COC3=CC=CC=C3O2)C#N

InChI

InChI=1S/C19H27N5O3/c1-22-19(21)24(13-20)10-14-6-8-23(9-7-14)15(11-25)18-12-26-16-4-2-3-5-17(16)27-18/h2-5,14-15,18,25H,6-12H2,1H3,(H2,21,22)