propan-2-yl (5E)-2,6-dimethyl-5-(1-methyl-2H-1,2,3,4-tetrazol-5-ylidene)-4-pyridin-4-yl-4H-pyridine-3-carboxylate

Systemtic Name: propan-2-yl (5E)-2,6-dimethyl-5-(1-methyl-2H-1,2,3,4-tetrazol-5-ylidene)-4-pyridin-4-yl-4H-pyridine-3-carboxylate Openeye Name: isopropyl (5E)-2,6-dimethyl-5-(1-methyl-2H-tetrazol-5-ylidene)-4-(4-pyridyl)-4H-pyridine-3-carboxylate CAS Name: (5E)-2,6-dimethyl-5-(1-methyl-2H-tetrazol-5-ylidene)-4-pyridin-4-yl-4H-pyridine-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (5E)-2,6-dimethyl-5-(1-methyl-2H-tetrazol-5-ylidene)-4-pyridin-4-yl-4H-pyridine-3-carboxylate Traditional Name: (5E)-2,6-dimethyl-5-(1-methyl-2H-tetrazol-5-ylidene)-4-(4-pyridyl)-4H-pyridine-3-carboxylic acid isopropyl ester Formula: C18H22N6O2 MolecularWeight: 354.40628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C2N=NNN2C)C(=N1)C)C3=CC=NC=C3)C(=O)OC(C)C

Isomeric SMILES

CC1=C(C(/C(=C/2\N=NNN2C)/C(=N1)C)C3=CC=NC=C3)C(=O)OC(C)C

InChI

InChI=1S/C18H22N6O2/c1-10(2)26-18(25)15-12(4)20-11(3)14(17-21-22-23-24(17)5)16(15)13-6-8-19-9-7-13/h6-10,16H,1-5H3,(H,21,23)/b17-14+