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6-oxidanylidene-1-(phenylmethyl)-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]pyridazine-3-carboxamide

6-oxidanylidene-1-(phenylmethyl)-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]pyridazine-3-carboxamide

Systemtic Name:6-oxidanylidene-1-(phenylmethyl)-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]pyridazine-3-carboxamide
Openeye Name:1-benzyl-6-oxo-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]pyridazine-3-carboxamide
CAS Name:6-oxo-1-(phenylmethyl)-N-[4-(1-pyrrolidin-1-iumylmethyl)phenyl]-3-pyridazinecarboxamide
IUPAC Name:1-benzyl-6-oxo-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]pyridazine-3-carboxamide
Traditional Name:1-benzyl-6-keto-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]pyridazine-3-carboxamide
Formula: C23H25N4O2+
MolecularWeight: 389.4702
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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)NC(=O)C3=NN(C(=O)C=C3)CC4=CC=CC=C4


Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)NC(=O)C3=NN(C(=O)C=C3)CC4=CC=CC=C4


InChI

InChI=1S/C23H24N4O2/c28-22-13-12-21(25-27(22)17-18-6-2-1-3-7-18)23(29)24-20-10-8-19(9-11-20)16-26-14-4-5-15-26/h1-3,6-13H,4-5,14-17H2,(H,24,29)/p+1


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