methyl 4-[[4-[3-(4-piperidin-1-ylphenyl)-1H-pyrazol-5-yl]phenyl]carbonylamino]butanoate

Systemtic Name: methyl 4-[[4-[3-(4-piperidin-1-ylphenyl)-1H-pyrazol-5-yl]phenyl]carbonylamino]butanoate Openeye Name: methyl 4-[[4-[3-[4-(1-piperidyl)phenyl]-1H-pyrazol-5-yl]benzoyl]amino]butanoate CAS Name: 4-[[oxo-[4-[3-[4-(1-piperidinyl)phenyl]-1H-pyrazol-5-yl]phenyl]methyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[4-[3-(4-piperidin-1-ylphenyl)-1H-pyrazol-5-yl]benzoyl]amino]butanoate Traditional Name: 4-[[4-[3-(4-piperidinophenyl)-1H-pyrazol-5-yl]benzoyl]amino]butyric acid methyl ester Formula: C26H30N4O3 MolecularWeight: 446.5414

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)C1=CC=C(C=C1)C2=CC(=NN2)C3=CC=C(C=C3)N4CCCCC4

Isomeric SMILES

COC(=O)CCCNC(=O)C1=CC=C(C=C1)C2=CC(=NN2)C3=CC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C26H30N4O3/c1-33-25(31)6-5-15-27-26(32)21-9-7-19(8-10-21)23-18-24(29-28-23)20-11-13-22(14-12-20)30-16-3-2-4-17-30/h7-14,18H,2-6,15-17H2,1H3,(H,27,32)(H,28,29)