5-(6-azanyl-5-methyl-3-phenyl-pyridazin-1-ium-1-yl)pentanoic acid

Systemtic Name: 5-(6-azanyl-5-methyl-3-phenyl-pyridazin-1-ium-1-yl)pentanoic acid Openeye Name: 5-(6-amino-5-methyl-3-phenyl-pyridazin-1-ium-1-yl)pentanoic acid CAS Name: 5-(6-amino-5-methyl-3-phenyl-1-pyridazin-1-iumyl)pentanoic acid IUPAC Name: 5-(6-amino-5-methyl-3-phenylpyridazin-1-ium-1-yl)pentanoic acid Traditional Name: 5-(6-amino-5-methyl-3-phenyl-pyridazin-1-ium-1-yl)valeric acid Formula: C16H20N3O2+ MolecularWeight: 286.3489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=N[N+](=C1N)CCCCC(=O)O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=N[N+](=C1N)CCCCC(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C16H19N3O2/c1-12-11-14(13-7-3-2-4-8-13)18-19(16(12)17)10-6-5-9-15(20)21/h2-4,7-8,11,17H,5-6,9-10H2,1H3,(H,20,21)/p+1