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

Systemtic Name: 2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-6-naphthalen-2-yl-pyridazin-3-one Openeye Name: 2-[2-(azepan-1-yl)-2-oxo-ethyl]-6-(2-naphthyl)pyridazin-3-one CAS Name: 2-[2-(1-azepanyl)-2-oxoethyl]-6-(2-naphthalenyl)-3-pyridazinone IUPAC Name: 2-[2-(azepan-1-yl)-2-oxoethyl]-6-naphthalen-2-ylpyridazin-3-one Traditional Name: 2-[2-(azepan-1-yl)-2-keto-ethyl]-6-(2-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=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C(=O)C=CC(=N2)C3=CC4=CC=CC=C4C=C3

InChI

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