1-[(2S)-2-[5-(4-hydroxyphenyl)pentanoyl]pyrrolidin-1-yl]-3,3-dimethyl-pentane-1,2-dione

Systemtic Name: 1-[(2S)-2-[5-(4-hydroxyphenyl)pentanoyl]pyrrolidin-1-yl]-3,3-dimethyl-pentane-1,2-dione Openeye Name: 1-[(2S)-2-[5-(4-hydroxyphenyl)pentanoyl]pyrrolidin-1-yl]-3,3-dimethyl-pentane-1,2-dione CAS Name: 1-[(2S)-2-[5-(4-hydroxyphenyl)-1-oxopentyl]-1-pyrrolidinyl]-3,3-dimethylpentane-1,2-dione IUPAC Name: 1-[(2S)-2-[5-(4-hydroxyphenyl)pentanoyl]pyrrolidin-1-yl]-3,3-dimethylpentane-1,2-dione Traditional Name: 1-[(2S)-2-[5-(4-hydroxyphenyl)pentanoyl]pyrrolidino]-3,3-dimethyl-pentane-1,2-dione Formula: C22H31NO4 MolecularWeight: 373.48584

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)C(=O)N1CCCC1C(=O)CCCCC2=CC=C(C=C2)O

Isomeric SMILES

CCC(C)(C)C(=O)C(=O)N1CCC[C@H]1C(=O)CCCCC2=CC=C(C=C2)O

InChI

InChI=1S/C22H31NO4/c1-4-22(2,3)20(26)21(27)23-15-7-9-18(23)19(25)10-6-5-8-16-11-13-17(24)14-12-16/h11-14,18,24H,4-10,15H2,1-3H3/t18-/m0/s1