(5-methoxycarbonyl-4-methyl-furan-2-yl)methyl 3,5-dimethyl-1-(phenylmethyl)pyrazole-4-carboxylate

Systemtic Name: (5-methoxycarbonyl-4-methyl-furan-2-yl)methyl 3,5-dimethyl-1-(phenylmethyl)pyrazole-4-carboxylate Openeye Name: (5-methoxycarbonyl-4-methyl-2-furyl)methyl 1-benzyl-3,5-dimethyl-pyrazole-4-carboxylate CAS Name: 3,5-dimethyl-1-(phenylmethyl)-4-pyrazolecarboxylic acid (5-methoxycarbonyl-4-methyl-2-furanyl)methyl ester IUPAC Name: (5-methoxycarbonyl-4-methylfuran-2-yl)methyl 1-benzyl-3,5-dimethylpyrazole-4-carboxylate Traditional Name: 1-benzyl-3,5-dimethyl-pyrazole-4-carboxylic acid (5-carbomethoxy-4-methyl-2-furyl)methyl ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)COC(=O)C2=C(N(N=C2C)CC3=CC=CC=C3)C)C(=O)OC

Isomeric SMILES

CC1=C(OC(=C1)COC(=O)C2=C(N(N=C2C)CC3=CC=CC=C3)C)C(=O)OC

InChI

InChI=1S/C21H22N2O5/c1-13-10-17(28-19(13)21(25)26-4)12-27-20(24)18-14(2)22-23(15(18)3)11-16-8-6-5-7-9-16/h5-10H,11-12H2,1-4H3