6-[[2,2-bis(methoxymethyl)-3-oxidanyl-chromen-4-yl]amino]-2-propyl-pyridazin-3-one

Systemtic Name: 6-[[2,2-bis(methoxymethyl)-3-oxidanyl-chromen-4-yl]amino]-2-propyl-pyridazin-3-one Openeye Name: 6-[[3-hydroxy-2,2-bis(methoxymethyl)chromen-4-yl]amino]-2-propyl-pyridazin-3-one CAS Name: 6-[[3-hydroxy-2,2-bis(methoxymethyl)-1-benzopyran-4-yl]amino]-2-propyl-3-pyridazinone IUPAC Name: 6-[[3-hydroxy-2,2-bis(methoxymethyl)chromen-4-yl]amino]-2-propylpyridazin-3-one Traditional Name: 6-[[3-hydroxy-2,2-bis(methoxymethyl)chromen-4-yl]amino]-2-propyl-pyridazin-3-one Formula: C20H25N3O5 MolecularWeight: 387.4296

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)NC2=C(C(OC3=CC=CC=C32)(COC)COC)O

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)NC2=C(C(OC3=CC=CC=C32)(COC)COC)O

InChI

InChI=1S/C20H25N3O5/c1-4-11-23-17(24)10-9-16(22-23)21-18-14-7-5-6-8-15(14)28-20(12-26-2,13-27-3)19(18)25/h5-10,25H,4,11-13H2,1-3H3,(H,21,22)