N-[2-[1-(2,3,4-trimethoxyphenyl)carbonylpiperidin-4-yl]pyrazol-3-yl]cyclopropanecarboxamide

Systemtic Name: N-[2-[1-(2,3,4-trimethoxyphenyl)carbonylpiperidin-4-yl]pyrazol-3-yl]cyclopropanecarboxamide Openeye Name: N-[2-[1-(2,3,4-trimethoxybenzoyl)-4-piperidyl]pyrazol-3-yl]cyclopropanecarboxamide CAS Name: N-[2-[1-[oxo-(2,3,4-trimethoxyphenyl)methyl]-4-piperidinyl]-3-pyrazolyl]cyclopropanecarboxamide IUPAC Name: N-[2-[1-(2,3,4-trimethoxybenzoyl)piperidin-4-yl]pyrazol-3-yl]cyclopropanecarboxamide Traditional Name: N-[2-[1-(2,3,4-trimethoxybenzoyl)-4-piperidyl]pyrazol-3-yl]cyclopropanecarboxamide Formula: C22H28N4O5 MolecularWeight: 428.48152

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(=O)N2CCC(CC2)N3C(=CC=N3)NC(=O)C4CC4)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C(=O)N2CCC(CC2)N3C(=CC=N3)NC(=O)C4CC4)OC)OC

InChI

InChI=1S/C22H28N4O5/c1-29-17-7-6-16(19(30-2)20(17)31-3)22(28)25-12-9-15(10-13-25)26-18(8-11-23-26)24-21(27)14-4-5-14/h6-8,11,14-15H,4-5,9-10,12-13H2,1-3H3,(H,24,27)