3-(4,8-dimethyl-2-oxidanylidene-4aH-quinolin-1-ium-1-yl)propanoic acid

Systemtic Name: 3-(4,8-dimethyl-2-oxidanylidene-4aH-quinolin-1-ium-1-yl)propanoic acid Openeye Name: 3-(4,8-dimethyl-2-oxo-4aH-quinolin-1-ium-1-yl)propanoic acid CAS Name: 3-(4,8-dimethyl-2-oxo-4aH-quinolin-1-ium-1-yl)propanoic acid IUPAC Name: 3-(4,8-dimethyl-2-oxo-4aH-quinolin-1-ium-1-yl)propanoic acid Traditional Name: 3-(2-keto-4,8-dimethyl-4aH-quinolin-1-ium-1-yl)propionic acid Formula: C14H16NO3+ MolecularWeight: 246.28174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2C1=[N+](C(=O)C=C2C)CCC(=O)O

Isomeric SMILES

CC1=CC=CC2C1=[N+](C(=O)C=C2C)CCC(=O)O

InChI

InChI=1S/C14H15NO3/c1-9-4-3-5-11-10(2)8-12(16)15(14(9)11)7-6-13(17)18/h3-5,8,11H,6-7H2,1-2H3/p+1