N-(2,6-diethylphenyl)-2-[1-(phenylcarbonyl)piperidin-4-yl]carbonyl-pyrazolidine-1-carboxamide

Systemtic Name: N-(2,6-diethylphenyl)-2-[1-(phenylcarbonyl)piperidin-4-yl]carbonyl-pyrazolidine-1-carboxamide Openeye Name: 2-(1-benzoylpiperidine-4-carbonyl)-N-(2,6-diethylphenyl)pyrazolidine-1-carboxamide CAS Name: 2-[(1-benzoyl-4-piperidinyl)-oxomethyl]-N-(2,6-diethylphenyl)-1-pyrazolidinecarboxamide IUPAC Name: 2-(1-benzoylpiperidine-4-carbonyl)-N-(2,6-diethylphenyl)pyrazolidine-1-carboxamide Traditional Name: 2-(1-benzoylisonipecotoyl)-N-(2,6-diethylphenyl)pyrazolidine-1-carboxamide Formula: C27H34N4O3 MolecularWeight: 462.58386

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)N2CCCN2C(=O)C3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)N2CCCN2C(=O)C3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H34N4O3/c1-3-20-12-8-13-21(4-2)24(20)28-27(34)31-17-9-16-30(31)26(33)23-14-18-29(19-15-23)25(32)22-10-6-5-7-11-22/h5-8,10-13,23H,3-4,9,14-19H2,1-2H3,(H,28,34)