ditert-butyl 1-carbamimidoylpyrazole-3,4-dicarboxylate

Systemtic Name: ditert-butyl 1-carbamimidoylpyrazole-3,4-dicarboxylate Openeye Name: ditert-butyl 1-carbamimidoylpyrazole-3,4-dicarboxylate CAS Name: 1-carbamimidoylpyrazole-3,4-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 1-carbamimidoylpyrazole-3,4-dicarboxylate Traditional Name: 1-amidinopyrazole-3,4-dicarboxylic acid ditert-butyl ester Formula: C14H22N4O4 MolecularWeight: 310.34888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CN(N=C1C(=O)OC(C)(C)C)C(=N)N

Isomeric SMILES

CC(C)(C)OC(=O)C1=CN(N=C1C(=O)OC(C)(C)C)C(=N)N

InChI

InChI=1S/C14H22N4O4/c1-13(2,3)21-10(19)8-7-18(12(15)16)17-9(8)11(20)22-14(4,5)6/h7H,1-6H3,(H3,15,16)