5-[2-butyl-5-(1,1-dimethoxypropyl)-1,2,4-triazol-3-yl]-3-methyl-2-phenyl-pyridine-4-carboxylic acid

Systemtic Name: 5-[2-butyl-5-(1,1-dimethoxypropyl)-1,2,4-triazol-3-yl]-3-methyl-2-phenyl-pyridine-4-carboxylic acid Openeye Name: 5-[2-butyl-5-(1,1-dimethoxypropyl)-1,2,4-triazol-3-yl]-3-methyl-2-phenyl-pyridine-4-carboxylic acid CAS Name: 5-[2-butyl-5-(1,1-dimethoxypropyl)-1,2,4-triazol-3-yl]-3-methyl-2-phenyl-4-pyridinecarboxylic acid IUPAC Name: 5-[2-butyl-5-(1,1-dimethoxypropyl)-1,2,4-triazol-3-yl]-3-methyl-2-phenylpyridine-4-carboxylic acid Traditional Name: 5-[2-butyl-5-(1,1-dimethoxypropyl)-1,2,4-triazol-3-yl]-3-methyl-2-phenyl-isonicotinic acid Formula: C24H30N4O4 MolecularWeight: 438.5194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NC(=N1)C(CC)(OC)OC)C2=CN=C(C(=C2C(=O)O)C)C3=CC=CC=C3

Isomeric SMILES

CCCCN1C(=NC(=N1)C(CC)(OC)OC)C2=CN=C(C(=C2C(=O)O)C)C3=CC=CC=C3

InChI

InChI=1S/C24H30N4O4/c1-6-8-14-28-21(26-23(27-28)24(7-2,31-4)32-5)18-15-25-20(16(3)19(18)22(29)30)17-12-10-9-11-13-17/h9-13,15H,6-8,14H2,1-5H3,(H,29,30)