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

Systemtic Name: 6-methyl-4-oxidanylidene-1-phenyl-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]pyridazine-3-carboxamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-6-methyl-4-oxo-1-phenyl-pyridazine-3-carboxamide CAS Name: 6-methyl-4-oxo-1-phenyl-N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]-3-pyridazinecarboxamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-4-keto-6-methyl-1-phenyl-pyridazine-3-carboxamide Formula: C23H25N4O2+ MolecularWeight: 389.4702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2)C(=O)NC3CC[NH+](C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2)C(=O)N[C@H]3CC[NH+](C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H24N4O2/c1-17-14-21(28)22(25-27(17)20-10-6-3-7-11-20)23(29)24-19-12-13-26(16-19)15-18-8-4-2-5-9-18/h2-11,14,19H,12-13,15-16H2,1H3,(H,24,29)/p+1/t19-/m0/s1