2-(4-chlorophenyl)-6-(4-cyclopentylpiperazin-4-ium-1-yl)carbonyl-1,4-dihydropyridazin-3-one

Systemtic Name: 2-(4-chlorophenyl)-6-(4-cyclopentylpiperazin-4-ium-1-yl)carbonyl-1,4-dihydropyridazin-3-one Openeye Name: 2-(4-chlorophenyl)-6-(4-cyclopentylpiperazin-4-ium-1-carbonyl)-1,4-dihydropyridazin-3-one CAS Name: 2-(4-chlorophenyl)-6-[(4-cyclopentyl-1-piperazin-4-iumyl)-oxomethyl]-1,4-dihydropyridazin-3-one IUPAC Name: 2-(4-chlorophenyl)-6-(4-cyclopentylpiperazin-4-ium-1-carbonyl)-1,4-dihydropyridazin-3-one Traditional Name: 2-(4-chlorophenyl)-6-(4-cyclopentylpiperazin-4-ium-1-carbonyl)-1,4-dihydropyridazin-3-one Formula: C20H26ClN4O2+ MolecularWeight: 389.89904

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCN(CC2)C(=O)C3=CCC(=O)N(N3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCC(C1)[NH+]2CCN(CC2)C(=O)C3=CCC(=O)N(N3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H25ClN4O2/c21-15-5-7-17(8-6-15)25-19(26)10-9-18(22-25)20(27)24-13-11-23(12-14-24)16-3-1-2-4-16/h5-9,16,22H,1-4,10-14H2/p+1