methyl 9-(3,4-diphenylpyrazol-1-yl)nonanoate

Systemtic Name: methyl 9-(3,4-diphenylpyrazol-1-yl)nonanoate Openeye Name: methyl 9-(3,4-diphenylpyrazol-1-yl)nonanoate CAS Name: 9-(3,4-diphenyl-1-pyrazolyl)nonanoic acid methyl ester IUPAC Name: methyl 9-(3,4-diphenylpyrazol-1-yl)nonanoate Traditional Name: 9-(3,4-diphenylpyrazol-1-yl)pelargonic acid methyl ester Formula: C25H30N2O2 MolecularWeight: 390.5179

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCCCN1C=C(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)CCCCCCCCN1C=C(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H30N2O2/c1-29-24(28)18-12-4-2-3-5-13-19-27-20-23(21-14-8-6-9-15-21)25(26-27)22-16-10-7-11-17-22/h6-11,14-17,20H,2-5,12-13,18-19H2,1H3