2-[6-[2-(2-methylpyrrolidin-1-yl)ethyl]naphthalen-2-yl]pyridazin-3-one sulfate

Systemtic Name: 2-[6-[2-(2-methylpyrrolidin-1-yl)ethyl]naphthalen-2-yl]pyridazin-3-one sulfate Openeye Name: 2-[6-[2-(2-methylpyrrolidin-1-yl)ethyl]-2-naphthyl]pyridazin-3-one sulfate CAS Name: 2-[6-[2-(2-methyl-1-pyrrolidinyl)ethyl]-2-naphthalenyl]-3-pyridazinone sulfate IUPAC Name: 2-[6-[2-(2-methylpyrrolidin-1-yl)ethyl]naphthalen-2-yl]pyridazin-3-one sulfate Traditional Name: 2-[6-[2-(2-methylpyrrolidino)ethyl]-2-naphthyl]pyridazin-3-one sulfate Formula: C21H23N3O5S-2 MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN1CCC2=CC3=C(C=C2)C=C(C=C3)N4C(=O)C=CC=N4.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CC1CCCN1CCC2=CC3=C(C=C2)C=C(C=C3)N4C(=O)C=CC=N4.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C21H23N3O.H2O4S/c1-16-4-3-12-23(16)13-10-17-6-7-19-15-20(9-8-18(19)14-17)24-21(25)5-2-11-22-24;1-5(2,3)4/h2,5-9,11,14-16H,3-4,10,12-13H2,1H3;(H2,1,2,3,4)/p-2