dimethyl 3-[4-[(2-methoxycarbonylphenyl)carbonylamino]pyrazol-1-yl]pentanedioate

Systemtic Name: dimethyl 3-[4-[(2-methoxycarbonylphenyl)carbonylamino]pyrazol-1-yl]pentanedioate Openeye Name: dimethyl 3-[4-[(2-methoxycarbonylbenzoyl)amino]pyrazol-1-yl]pentanedioate CAS Name: 3-[4-[[(2-methoxycarbonylphenyl)-oxomethyl]amino]-1-pyrazolyl]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 3-[4-[(2-methoxycarbonylbenzoyl)amino]pyrazol-1-yl]pentanedioate Traditional Name: 3-[4-[(2-carbomethoxybenzoyl)amino]pyrazol-1-yl]glutaric acid dimethyl ester Formula: C19H21N3O7 MolecularWeight: 403.38594

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CC(=O)OC)N1C=C(C=N1)NC(=O)C2=CC=CC=C2C(=O)OC

Isomeric SMILES

COC(=O)CC(CC(=O)OC)N1C=C(C=N1)NC(=O)C2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C19H21N3O7/c1-27-16(23)8-13(9-17(24)28-2)22-11-12(10-20-22)21-18(25)14-6-4-5-7-15(14)19(26)29-3/h4-7,10-11,13H,8-9H2,1-3H3,(H,21,25)