2-methyl-6-[(4-methyl-1,4-diazepan-1-yl)carbonyl]pyridine-3-carboxylic acid

Systemtic Name: 2-methyl-6-[(4-methyl-1,4-diazepan-1-yl)carbonyl]pyridine-3-carboxylic acid Openeye Name: 2-methyl-6-(4-methyl-1,4-diazepane-1-carbonyl)pyridine-3-carboxylic acid CAS Name: 2-methyl-6-[(4-methyl-1,4-diazepan-1-yl)-oxomethyl]-3-pyridinecarboxylic acid IUPAC Name: 2-methyl-6-(4-methyl-1,4-diazepane-1-carbonyl)pyridine-3-carboxylic acid Traditional Name: 2-methyl-6-(4-methyl-1,4-diazepane-1-carbonyl)nicotinic acid Formula: C14H19N3O3 MolecularWeight: 277.31896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)C(=O)N2CCCN(CC2)C)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=N1)C(=O)N2CCCN(CC2)C)C(=O)O

InChI

InChI=1S/C14H19N3O3/c1-10-11(14(19)20)4-5-12(15-10)13(18)17-7-3-6-16(2)8-9-17/h4-5H,3,6-9H2,1-2H3,(H,19,20)