2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-6-naphthalen-1-yl-pyridazin-3-one

Systemtic Name: 2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-6-naphthalen-1-yl-pyridazin-3-one Openeye Name: 2-[2-(azepan-1-yl)-2-oxo-ethyl]-6-(1-naphthyl)pyridazin-3-one CAS Name: 2-[2-(1-azepanyl)-2-oxoethyl]-6-(1-naphthalenyl)-3-pyridazinone IUPAC Name: 2-[2-(azepan-1-yl)-2-oxoethyl]-6-naphthalen-1-ylpyridazin-3-one Traditional Name: 2-[2-(azepan-1-yl)-2-keto-ethyl]-6-(1-naphthyl)pyridazin-3-one Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C(=O)C=CC(=N2)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C(=O)C=CC(=N2)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H23N3O2/c26-21-13-12-20(19-11-7-9-17-8-3-4-10-18(17)19)23-25(21)16-22(27)24-14-5-1-2-6-15-24/h3-4,7-13H,1-2,5-6,14-16H2