methyl 7-[[3-(3-methoxyphenyl)-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]heptanoate

Systemtic Name: methyl 7-[[3-(3-methoxyphenyl)-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]heptanoate Openeye Name: methyl 7-[[1-benzyl-3-(3-methoxyphenyl)pyrazole-4-carbonyl]amino]heptanoate CAS Name: 7-[[[3-(3-methoxyphenyl)-1-(phenylmethyl)-4-pyrazolyl]-oxomethyl]amino]heptanoic acid methyl ester IUPAC Name: methyl 7-[[1-benzyl-3-(3-methoxyphenyl)pyrazole-4-carbonyl]amino]heptanoate Traditional Name: 7-[[1-benzyl-3-(3-methoxyphenyl)pyrazole-4-carbonyl]amino]enanthic acid methyl ester Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)NCCCCCCC(=O)OC)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)NCCCCCCC(=O)OC)CC3=CC=CC=C3

InChI

InChI=1S/C26H31N3O4/c1-32-22-14-10-13-21(17-22)25-23(19-29(28-25)18-20-11-6-5-7-12-20)26(31)27-16-9-4-3-8-15-24(30)33-2/h5-7,10-14,17,19H,3-4,8-9,15-16,18H2,1-2H3,(H,27,31)