3-(6-propan-2-ylphthalazin-2-ium-2-yl)propanoic acid

Systemtic Name: 3-(6-propan-2-ylphthalazin-2-ium-2-yl)propanoic acid Openeye Name: 3-(6-isopropylphthalazin-2-ium-2-yl)propanoic acid CAS Name: 3-(6-propan-2-yl-2-phthalazin-2-iumyl)propanoic acid IUPAC Name: 3-(6-propan-2-ylphthalazin-2-ium-2-yl)propanoic acid Traditional Name: 3-(6-isopropylphthalazin-2-ium-2-yl)propionic acid Formula: C14H17N2O2+ MolecularWeight: 245.29698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=CN=[N+](C=C2C=C1)CCC(=O)O

Isomeric SMILES

CC(C)C1=CC2=CN=[N+](C=C2C=C1)CCC(=O)O

InChI

InChI=1S/C14H16N2O2/c1-10(2)11-3-4-12-9-16(6-5-14(17)18)15-8-13(12)7-11/h3-4,7-10H,5-6H2,1-2H3/p+1