2-[3-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl-(phenylmethyl)amino]propyl]pyridazin-3-one

Systemtic Name: 2-[3-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl-(phenylmethyl)amino]propyl]pyridazin-3-one Openeye Name: 2-[3-[benzyl(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)amino]propyl]pyridazin-3-one CAS Name: 2-[3-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl-(phenylmethyl)amino]propyl]-3-pyridazinone IUPAC Name: 2-[3-[benzyl(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)amino]propyl]pyridazin-3-one Traditional Name: 2-[3-[benzyl(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)amino]propyl]pyridazin-3-one Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CN(CCCN3C(=O)C=CC=N3)CC4=CC=CC=C4

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)CN(CCCN3C(=O)C=CC=N3)CC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O3/c27-23-12-6-13-24-26(23)15-7-14-25(16-19-8-2-1-3-9-19)17-20-18-28-21-10-4-5-11-22(21)29-20/h1-6,8-13,20H,7,14-18H2