1-butylpyrrolidin-2-one; 3,5,5-trimethylcyclohex-2-en-1-one

Systemtic Name: 1-butylpyrrolidin-2-one; 3,5,5-trimethylcyclohex-2-en-1-one Openeye Name: 1-butylpyrrolidin-2-one; 3,5,5-trimethylcyclohex-2-en-1-one CAS Name: 1-butyl-2-pyrrolidinone; 3,5,5-trimethyl-1-cyclohex-2-enone IUPAC Name: 1-butylpyrrolidin-2-one; 3,5,5-trimethylcyclohex-2-en-1-one Traditional Name: 1-butyl-2-pyrrolidone; 3,5,5-trimethylcyclohex-2-en-1-one Formula: C17H29NO2 MolecularWeight: 279.41766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCCC1=O.CC1=CC(=O)CC(C1)(C)C

Isomeric SMILES

CCCCN1CCCC1=O.CC1=CC(=O)CC(C1)(C)C

InChI

InChI=1S/C9H14O.C8H15NO/c1-7-4-8(10)6-9(2,3)5-7;1-2-3-6-9-7-4-5-8(9)10/h4H,5-6H2,1-3H3;2-7H2,1H3