4-[(5-tert-butyl-4,5,6,7-tetrahydro-1,2-benzoxazol-3-yl)carbonylamino]-2-methyl-pyrazole-3-carboxylic acid

Systemtic Name: 4-[(5-tert-butyl-4,5,6,7-tetrahydro-1,2-benzoxazol-3-yl)carbonylamino]-2-methyl-pyrazole-3-carboxylic acid Openeye Name: 4-[(5-tert-butyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl)amino]-2-methyl-pyrazole-3-carboxylic acid CAS Name: 4-[[(5-tert-butyl-4,5,6,7-tetrahydro-1,2-benzoxazol-3-yl)-oxomethyl]amino]-2-methyl-3-pyrazolecarboxylic acid IUPAC Name: 4-[(5-tert-butyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl)amino]-2-methylpyrazole-3-carboxylic acid Traditional Name: 4-[(5-tert-butyl-4,5,6,7-tetrahydroindoxazene-3-carbonyl)amino]-2-methyl-pyrazole-3-carboxylic acid Formula: C17H22N4O4 MolecularWeight: 346.38098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C(=NO2)C(=O)NC3=C(N(N=C3)C)C(=O)O

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)C(=NO2)C(=O)NC3=C(N(N=C3)C)C(=O)O

InChI

InChI=1S/C17H22N4O4/c1-17(2,3)9-5-6-12-10(7-9)13(20-25-12)15(22)19-11-8-18-21(4)14(11)16(23)24/h8-9H,5-7H2,1-4H3,(H,19,22)(H,23,24)