ethanoic acid; 3-(2-ethyl-1-methyl-3-propyl-pyrrolidin-3-yl)phenol

Systemtic Name: ethanoic acid; 3-(2-ethyl-1-methyl-3-propyl-pyrrolidin-3-yl)phenol Openeye Name: acetic acid; 3-(2-ethyl-1-methyl-3-propyl-pyrrolidin-3-yl)phenol CAS Name: acetic acid; 3-(2-ethyl-1-methyl-3-propyl-3-pyrrolidinyl)phenol IUPAC Name: acetic acid; 3-(2-ethyl-1-methyl-3-propylpyrrolidin-3-yl)phenol Traditional Name: acetic acid; 3-(2-ethyl-1-methyl-3-propyl-pyrrolidin-3-yl)phenol Formula: C18H29NO3 MolecularWeight: 307.42776

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCN(C1CC)C)C2=CC(=CC=C2)O.CC(=O)O

Isomeric SMILES

CCCC1(CCN(C1CC)C)C2=CC(=CC=C2)O.CC(=O)O

InChI

InChI=1S/C16H25NO.C2H4O2/c1-4-9-16(10-11-17(3)15(16)5-2)13-7-6-8-14(18)12-13;1-2(3)4/h6-8,12,15,18H,4-5,9-11H2,1-3H3;1H3,(H,3,4)