(3S,4R)-1-butyl-4,5,5-trimethyl-3-(1-oxidanylcyclohexyl)carbonyl-pyrrolidin-2-one

Systemtic Name: (3S,4R)-1-butyl-4,5,5-trimethyl-3-(1-oxidanylcyclohexyl)carbonyl-pyrrolidin-2-one Openeye Name: (3S,4R)-1-butyl-3-(1-hydroxycyclohexanecarbonyl)-4,5,5-trimethyl-pyrrolidin-2-one CAS Name: (3S,4R)-1-butyl-3-[(1-hydroxycyclohexyl)-oxomethyl]-4,5,5-trimethyl-2-pyrrolidinone IUPAC Name: (3S,4R)-1-butyl-3-(1-hydroxycyclohexanecarbonyl)-4,5,5-trimethylpyrrolidin-2-one Traditional Name: (3S,4R)-1-butyl-3-(1-hydroxycyclohexanecarbonyl)-4,5,5-trimethyl-2-pyrrolidone Formula: C18H31NO3 MolecularWeight: 309.44364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(C(C1(C)C)C)C(=O)C2(CCCCC2)O

Isomeric SMILES

CCCCN1C(=O)[C@@H]([C@H](C1(C)C)C)C(=O)C2(CCCCC2)O

InChI

InChI=1S/C18H31NO3/c1-5-6-12-19-16(21)14(13(2)17(19,3)4)15(20)18(22)10-8-7-9-11-18/h13-14,22H,5-12H2,1-4H3/t13-,14+/m1/s1