5-methyl-2-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylate; propan-2-ylazanium

Systemtic Name: 5-methyl-2-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylate; propan-2-ylazanium Openeye Name: isopropylammonium; 2-(4-isopropyl-4-methyl-5-oxo-1H-imidazol-2-yl)-5-methyl-pyridine-3-carboxylate CAS Name: 5-methyl-2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-3-pyridinecarboxylate; propan-2-ylammonium IUPAC Name: 5-methyl-2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylate; propan-2-ylazanium Traditional Name: isopropylammonium; 2-(4-isopropyl-5-keto-4-methyl-2-imidazolin-2-yl)-5-methyl-nicotinate Formula: C17H26N4O3 MolecularWeight: 334.41334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=C1)C(=O)[O-])C2=NC(C(=O)N2)(C)C(C)C.CC(C)[NH3+]

Isomeric SMILES

CC1=CN=C(C(=C1)C(=O)[O-])C2=NC(C(=O)N2)(C)C(C)C.CC(C)[NH3+]

InChI

InChI=1S/C14H17N3O3.C3H9N/c1-7(2)14(4)13(20)16-11(17-14)10-9(12(18)19)5-8(3)6-15-10;1-3(2)4/h5-7H,1-4H3,(H,18,19)(H,16,17,20);3H,4H2,1-2H3