1-[2,3-bis(azanyl)-4-methyl-phenoxy]-3-[4-(phenoxymethyl)piperidin-1-yl]propan-2-ol

Systemtic Name: 1-[2,3-bis(azanyl)-4-methyl-phenoxy]-3-[4-(phenoxymethyl)piperidin-1-yl]propan-2-ol Openeye Name: 1-(2,3-diamino-4-methyl-phenoxy)-3-[4-(phenoxymethyl)-1-piperidyl]propan-2-ol CAS Name: 1-(2,3-diamino-4-methylphenoxy)-3-[4-(phenoxymethyl)-1-piperidinyl]-2-propanol IUPAC Name: 1-(2,3-diamino-4-methylphenoxy)-3-[4-(phenoxymethyl)piperidin-1-yl]propan-2-ol Traditional Name: 1-(2,3-diamino-4-methyl-phenoxy)-3-[4-(phenoxymethyl)piperidino]propan-2-ol Formula: C22H31N3O3 MolecularWeight: 385.49984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)OCC(CN2CCC(CC2)COC3=CC=CC=C3)O)N)N

Isomeric SMILES

CC1=C(C(=C(C=C1)OCC(CN2CCC(CC2)COC3=CC=CC=C3)O)N)N

InChI

InChI=1S/C22H31N3O3/c1-16-7-8-20(22(24)21(16)23)28-15-18(26)13-25-11-9-17(10-12-25)14-27-19-5-3-2-4-6-19/h2-8,17-18,26H,9-15,23-24H2,1H3