dimethyl 3-[4-(but-2-ynoxycarbonylamino)pyrazol-1-yl]pentanedioate

Systemtic Name: dimethyl 3-[4-(but-2-ynoxycarbonylamino)pyrazol-1-yl]pentanedioate Openeye Name: dimethyl 3-[4-(but-2-ynoxycarbonylamino)pyrazol-1-yl]pentanedioate CAS Name: 3-[4-[[but-2-ynoxy(oxo)methyl]amino]-1-pyrazolyl]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 3-[4-(but-2-ynoxycarbonylamino)pyrazol-1-yl]pentanedioate Traditional Name: 3-[4-(but-2-ynoxycarbonylamino)pyrazol-1-yl]glutaric acid dimethyl ester Formula: C15H19N3O6 MolecularWeight: 337.32786

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC(=O)NC1=CN(N=C1)C(CC(=O)OC)CC(=O)OC

Isomeric SMILES

CC#CCOC(=O)NC1=CN(N=C1)C(CC(=O)OC)CC(=O)OC

InChI

InChI=1S/C15H19N3O6/c1-4-5-6-24-15(21)17-11-9-16-18(10-11)12(7-13(19)22-2)8-14(20)23-3/h9-10,12H,6-8H2,1-3H3,(H,17,21)