1-[2-[(4,5-dimethyl-1-oxidanylidene-2H-furo[3,4-d]pyridazin-7-yl)amino]-2-oxidanylidene-ethyl]-N-(phenylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[(4,5-dimethyl-1-oxidanylidene-2H-furo[3,4-d]pyridazin-7-yl)amino]-2-oxidanylidene-ethyl]-N-(phenylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-benzyl-1-[2-[(4,5-dimethyl-1-oxo-2H-furo[3,4-d]pyridazin-7-yl)amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[(4,5-dimethyl-1-oxo-2H-furo[3,4-d]pyridazin-7-yl)amino]-2-oxoethyl]-N-(phenylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-benzyl-1-[2-[(4,5-dimethyl-1-oxo-2H-furo[3,4-d]pyridazin-7-yl)amino]-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: N-benzyl-1-[2-keto-2-[(1-keto-4,5-dimethyl-2H-furo[3,4-d]pyridazin-7-yl)amino]ethyl]piperidin-1-ium-4-carboxamide Formula: C23H28N5O4+ MolecularWeight: 438.49952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NNC(=O)C2=C(O1)NC(=O)C[NH+]3CCC(CC3)C(=O)NCC4=CC=CC=C4)C

Isomeric SMILES

CC1=C2C(=NNC(=O)C2=C(O1)NC(=O)C[NH+]3CCC(CC3)C(=O)NCC4=CC=CC=C4)C

InChI

InChI=1S/C23H27N5O4/c1-14-19-15(2)32-23(20(19)22(31)27-26-14)25-18(29)13-28-10-8-17(9-11-28)21(30)24-12-16-6-4-3-5-7-16/h3-7,17H,8-13H2,1-2H3,(H,24,30)(H,25,29)(H,27,31)/p+1