methyl 5-phenyl-2-[2-[4-(1,3,5-trimethylpyrazol-4-yl)phenyl]ethyl]pentanoate

Systemtic Name: methyl 5-phenyl-2-[2-[4-(1,3,5-trimethylpyrazol-4-yl)phenyl]ethyl]pentanoate Openeye Name: methyl 5-phenyl-2-[2-[4-(1,3,5-trimethylpyrazol-4-yl)phenyl]ethyl]pentanoate CAS Name: 5-phenyl-2-[2-[4-(1,3,5-trimethyl-4-pyrazolyl)phenyl]ethyl]pentanoic acid methyl ester IUPAC Name: methyl 5-phenyl-2-[2-[4-(1,3,5-trimethylpyrazol-4-yl)phenyl]ethyl]pentanoate Traditional Name: 5-phenyl-2-[2-[4-(1,3,5-trimethylpyrazol-4-yl)phenyl]ethyl]valeric acid methyl ester Formula: C26H32N2O2 MolecularWeight: 404.54448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C2=CC=C(C=C2)CCC(CCCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C)C)C2=CC=C(C=C2)CCC(CCCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C26H32N2O2/c1-19-25(20(2)28(3)27-19)23-16-13-22(14-17-23)15-18-24(26(29)30-4)12-8-11-21-9-6-5-7-10-21/h5-7,9-10,13-14,16-17,24H,8,11-12,15,18H2,1-4H3