(2R)-N-(4-benzamidocyclohexyl)-1-(2-ethylhexanoyl)pyrrolidine-2-carboxamide

Systemtic Name: (2R)-N-(4-benzamidocyclohexyl)-1-(2-ethylhexanoyl)pyrrolidine-2-carboxamide Openeye Name: (2R)-N-(4-benzamidocyclohexyl)-1-(2-ethylhexanoyl)pyrrolidine-2-carboxamide CAS Name: (2R)-N-(4-benzamidocyclohexyl)-1-(2-ethyl-1-oxohexyl)-2-pyrrolidinecarboxamide IUPAC Name: (2R)-N-(4-benzamidocyclohexyl)-1-(2-ethylhexanoyl)pyrrolidine-2-carboxamide Traditional Name: (2R)-N-(4-benzamidocyclohexyl)-1-(2-ethylhexanoyl)pyrrolidine-2-carboxamide Formula: C26H39N3O3 MolecularWeight: 441.60616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N1CCCC1C(=O)NC2CCC(CC2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCC(CC)C(=O)N1CCC[C@@H]1C(=O)NC2CCC(CC2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H39N3O3/c1-3-5-10-19(4-2)26(32)29-18-9-13-23(29)25(31)28-22-16-14-21(15-17-22)27-24(30)20-11-7-6-8-12-20/h6-8,11-12,19,21-23H,3-5,9-10,13-18H2,1-2H3,(H,27,30)(H,28,31)/t19?,21?,22?,23-/m1/s1