3-[4-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)piperazin-1-yl]-N-(4-nitrophenyl)propanamide

Systemtic Name: 3-[4-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)piperazin-1-yl]-N-(4-nitrophenyl)propanamide Openeye Name: 3-[4-(5-chloro-6-oxo-1-phenyl-pyridazin-4-yl)piperazin-1-yl]-N-(4-nitrophenyl)propanamide CAS Name: 3-[4-(5-chloro-6-oxo-1-phenyl-4-pyridazinyl)-1-piperazinyl]-N-(4-nitrophenyl)propanamide IUPAC Name: 3-[4-(5-chloro-6-oxo-1-phenylpyridazin-4-yl)piperazin-1-yl]-N-(4-nitrophenyl)propanamide Traditional Name: 3-[4-(5-chloro-6-keto-1-phenyl-pyridazin-4-yl)piperazino]-N-(4-nitrophenyl)propionamide Formula: C23H23ClN6O4 MolecularWeight: 482.91952

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

C1CN(CCN1CCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C23H23ClN6O4/c24-22-20(16-25-29(23(22)32)18-4-2-1-3-5-18)28-14-12-27(13-15-28)11-10-21(31)26-17-6-8-19(9-7-17)30(33)34/h1-9,16H,10-15H2,(H,26,31)