[2-[3-(4-methoxyphenyl)-5-naphthalen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl] 3-pyrazol-1-ylpropanoate

Systemtic Name: [2-[3-(4-methoxyphenyl)-5-naphthalen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl] 3-pyrazol-1-ylpropanoate Openeye Name: [2-[3-(4-methoxyphenyl)-5-(2-naphthyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethyl] 3-pyrazol-1-ylpropanoate CAS Name: 3-(1-pyrazolyl)propanoic acid [2-[3-(4-methoxyphenyl)-5-(2-naphthalenyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl] ester IUPAC Name: [2-[3-(4-methoxyphenyl)-5-naphthalen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl] 3-pyrazol-1-ylpropanoate Traditional Name: 3-pyrazol-1-ylpropionic acid [2-keto-2-[5-(4-methoxyphenyl)-3-(2-naphthyl)-2-pyrazolin-1-yl]ethyl] ester Formula: C28H26N4O4 MolecularWeight: 482.53044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=NN2C(=O)COC(=O)CCN3C=CC=N3)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2CC(=NN2C(=O)COC(=O)CCN3C=CC=N3)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C28H26N4O4/c1-35-24-11-9-21(10-12-24)26-18-25(23-8-7-20-5-2-3-6-22(20)17-23)30-32(26)27(33)19-36-28(34)13-16-31-15-4-14-29-31/h2-12,14-15,17,26H,13,16,18-19H2,1H3