N-[2-[1-(3-methyl-2-oxidanylidene-pentanoyl)piperidin-4-yl]pyrazol-3-yl]-3-phenoxy-propanamide

Systemtic Name: N-[2-[1-(3-methyl-2-oxidanylidene-pentanoyl)piperidin-4-yl]pyrazol-3-yl]-3-phenoxy-propanamide Openeye Name: N-[2-[1-(3-methyl-2-oxo-pentanoyl)-4-piperidyl]pyrazol-3-yl]-3-phenoxy-propanamide CAS Name: N-[2-[1-(3-methyl-1,2-dioxopentyl)-4-piperidinyl]-3-pyrazolyl]-3-phenoxypropanamide IUPAC Name: N-[2-[1-(3-methyl-2-oxopentanoyl)piperidin-4-yl]pyrazol-3-yl]-3-phenoxypropanamide Traditional Name: N-[2-[1-(2-keto-3-methyl-pentanoyl)-4-piperidyl]pyrazol-3-yl]-3-phenoxy-propionamide Formula: C23H30N4O4 MolecularWeight: 426.5087

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)C(=O)N1CCC(CC1)N2C(=CC=N2)NC(=O)CCOC3=CC=CC=C3

Isomeric SMILES

CCC(C)C(=O)C(=O)N1CCC(CC1)N2C(=CC=N2)NC(=O)CCOC3=CC=CC=C3

InChI

InChI=1S/C23H30N4O4/c1-3-17(2)22(29)23(30)26-14-10-18(11-15-26)27-20(9-13-24-27)25-21(28)12-16-31-19-7-5-4-6-8-19/h4-9,13,17-18H,3,10-12,14-16H2,1-2H3,(H,25,28)