6-[[2-(cyclopropylamino)-2-oxidanylidene-ethyl]carbamoyl]-2-methyl-pyridine-3-carboxylic acid

Systemtic Name: 6-[[2-(cyclopropylamino)-2-oxidanylidene-ethyl]carbamoyl]-2-methyl-pyridine-3-carboxylic acid Openeye Name: 6-[[2-(cyclopropylamino)-2-oxo-ethyl]carbamoyl]-2-methyl-pyridine-3-carboxylic acid CAS Name: 6-[[[2-(cyclopropylamino)-2-oxoethyl]amino]-oxomethyl]-2-methyl-3-pyridinecarboxylic acid IUPAC Name: 6-[[2-(cyclopropylamino)-2-oxoethyl]carbamoyl]-2-methylpyridine-3-carboxylic acid Traditional Name: 6-[[2-(cyclopropylamino)-2-keto-ethyl]carbamoyl]-2-methyl-nicotinic acid Formula: C13H15N3O4 MolecularWeight: 277.2759

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)C(=O)NCC(=O)NC2CC2)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=N1)C(=O)NCC(=O)NC2CC2)C(=O)O

InChI

InChI=1S/C13H15N3O4/c1-7-9(13(19)20)4-5-10(15-7)12(18)14-6-11(17)16-8-2-3-8/h4-5,8H,2-3,6H2,1H3,(H,14,18)(H,16,17)(H,19,20)