ethanoic acid; 3-(1-methyl-3-propyl-pyrrolidin-3-yl)phenol

Systemtic Name: ethanoic acid; 3-(1-methyl-3-propyl-pyrrolidin-3-yl)phenol Openeye Name: acetic acid; 3-(1-methyl-3-propyl-pyrrolidin-3-yl)phenol CAS Name: acetic acid; 3-(1-methyl-3-propyl-3-pyrrolidinyl)phenol IUPAC Name: acetic acid; 3-(1-methyl-3-propylpyrrolidin-3-yl)phenol Traditional Name: acetic acid; 3-(1-methyl-3-propyl-pyrrolidin-3-yl)phenol Formula: C16H25NO3 MolecularWeight: 279.3746

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCN(C1)C)C2=CC(=CC=C2)O.CC(=O)O

Isomeric SMILES

CCCC1(CCN(C1)C)C2=CC(=CC=C2)O.CC(=O)O

InChI

InChI=1S/C14H21NO.C2H4O2/c1-3-7-14(8-9-15(2)11-14)12-5-4-6-13(16)10-12;1-2(3)4/h4-6,10,16H,3,7-9,11H2,1-2H3;1H3,(H,3,4)