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

Systemtic Name: 1-methyl-6-[2-(4-methyl-1,4-diazepan-1-yl)phenyl]-2-oxidanylidene-pyridine-3-carboxylic acid Openeye Name: 1-methyl-6-[2-(4-methyl-1,4-diazepan-1-yl)phenyl]-2-oxo-pyridine-3-carboxylic acid CAS Name: 1-methyl-6-[2-(4-methyl-1,4-diazepan-1-yl)phenyl]-2-oxo-3-pyridinecarboxylic acid IUPAC Name: 1-methyl-6-[2-(4-methyl-1,4-diazepan-1-yl)phenyl]-2-oxopyridine-3-carboxylic acid Traditional Name: 2-keto-1-methyl-6-[2-(4-methyl-1,4-diazepan-1-yl)phenyl]nicotinic acid Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C2=CC=CC=C2C3=CC=C(C(=O)N3C)C(=O)O

Isomeric SMILES

CN1CCCN(CC1)C2=CC=CC=C2C3=CC=C(C(=O)N3C)C(=O)O

InChI

InChI=1S/C19H23N3O3/c1-20-10-5-11-22(13-12-20)17-7-4-3-6-14(17)16-9-8-15(19(24)25)18(23)21(16)2/h3-4,6-9H,5,10-13H2,1-2H3,(H,24,25)