1-[3-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-3-oxidanylidene-propyl]-6-oxidanylidene-pyridazin-3-olate

Systemtic Name: 1-[3-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-3-oxidanylidene-propyl]-6-oxidanylidene-pyridazin-3-olate Openeye Name: 1-[3-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-3-oxo-propyl]-6-oxo-pyridazin-3-olate CAS Name: 1-[3-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-3-oxopropyl]-6-oxo-3-pyridazinolate IUPAC Name: 1-[3-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-3-oxopropyl]-6-oxopyridazin-3-olate Traditional Name: 1-[3-[cyclopentyl(piperonyl)amino]-3-keto-propyl]-6-keto-pyridazin-3-olate Formula: C20H22N3O5- MolecularWeight: 384.40578

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)C(=O)CCN4C(=O)C=CC(=N4)[O-]

Isomeric SMILES

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)C(=O)CCN4C(=O)C=CC(=N4)[O-]

InChI

InChI=1S/C20H23N3O5/c24-18-7-8-20(26)23(21-18)10-9-19(25)22(15-3-1-2-4-15)12-14-5-6-16-17(11-14)28-13-27-16/h5-8,11,15H,1-4,9-10,12-13H2,(H,21,24)/p-1