2-[5-azanyl-6-ethyl-4-oxidanylidene-2-(phenoxymethyl)-7-(phenylmethyl)-1H-pyrrolo[1,2-b]pyridazin-3-yl]-2-oxidanylidene-ethanal

Systemtic Name: 2-[5-azanyl-6-ethyl-4-oxidanylidene-2-(phenoxymethyl)-7-(phenylmethyl)-1H-pyrrolo[1,2-b]pyridazin-3-yl]-2-oxidanylidene-ethanal Openeye Name: 2-[5-amino-7-benzyl-6-ethyl-4-oxo-2-(phenoxymethyl)-1H-pyrrolo[1,2-b]pyridazin-3-yl]-2-oxo-acetaldehyde CAS Name: 2-[5-amino-6-ethyl-4-oxo-2-(phenoxymethyl)-7-(phenylmethyl)-1H-pyrrolo[1,2-b]pyridazin-3-yl]-2-oxoacetaldehyde IUPAC Name: 2-[5-amino-7-benzyl-6-ethyl-4-oxo-2-(phenoxymethyl)-1H-pyrrolo[1,2-b]pyridazin-3-yl]-2-oxoacetaldehyde Traditional Name: 2-[5-amino-7-benzyl-6-ethyl-4-keto-2-(phenoxymethyl)-1H-pyrrolo[1,2-b]pyridazin-3-yl]-2-keto-acetaldehyde Formula: C25H23N3O4 MolecularWeight: 429.46782

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N2C(=C1N)C(=O)C(=C(N2)COC3=CC=CC=C3)C(=O)C=O)CC4=CC=CC=C4

Isomeric SMILES

CCC1=C(N2C(=C1N)C(=O)C(=C(N2)COC3=CC=CC=C3)C(=O)C=O)CC4=CC=CC=C4

InChI

InChI=1S/C25H23N3O4/c1-2-18-20(13-16-9-5-3-6-10-16)28-24(23(18)26)25(31)22(21(30)14-29)19(27-28)15-32-17-11-7-4-8-12-17/h3-12,14,27H,2,13,15,26H2,1H3