propanoic acid; 1,2,2-trimethyl-3-phenyl-pyrrolidin-3-ol

Systemtic Name: propanoic acid; 1,2,2-trimethyl-3-phenyl-pyrrolidin-3-ol Openeye Name: propionic acid; 1,2,2-trimethyl-3-phenyl-pyrrolidin-3-ol CAS Name: propanoic acid; 1,2,2-trimethyl-3-phenyl-3-pyrrolidinol IUPAC Name: propanoic acid; 1,2,2-trimethyl-3-phenylpyrrolidin-3-ol Traditional Name: propionic acid; 1,2,2-trimethyl-3-phenyl-pyrrolidin-3-ol Formula: C16H25NO3 MolecularWeight: 279.3746

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)O.CC1(C(CCN1C)(C2=CC=CC=C2)O)C

Isomeric SMILES

CCC(=O)O.CC1(C(CCN1C)(C2=CC=CC=C2)O)C

InChI

InChI=1S/C13H19NO.C3H6O2/c1-12(2)13(15,9-10-14(12)3)11-7-5-4-6-8-11;1-2-3(4)5/h4-8,15H,9-10H2,1-3H3;2H2,1H3,(H,4,5)