ethanedioic acid; 3-(2-methyl-1-prop-2-enyl-3-propyl-piperidin-3-yl)phenol

Systemtic Name: ethanedioic acid; 3-(2-methyl-1-prop-2-enyl-3-propyl-piperidin-3-yl)phenol Openeye Name: 3-(1-allyl-2-methyl-3-propyl-3-piperidyl)phenol; oxalic acid CAS Name: 3-(2-methyl-1-prop-2-enyl-3-propyl-3-piperidinyl)phenol; oxalic acid IUPAC Name: 3-(2-methyl-1-prop-2-enyl-3-propylpiperidin-3-yl)phenol; oxalic acid Traditional Name: 3-(1-allyl-2-methyl-3-propyl-3-piperidyl)phenol; oxalic acid Formula: C20H29NO5 MolecularWeight: 363.44796

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCCN(C1C)CC=C)C2=CC(=CC=C2)O.C(=O)(C(=O)O)O

Isomeric SMILES

CCCC1(CCCN(C1C)CC=C)C2=CC(=CC=C2)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H27NO.C2H2O4/c1-4-10-18(16-8-6-9-17(20)14-16)11-7-13-19(12-5-2)15(18)3;3-1(4)2(5)6/h5-6,8-9,14-15,20H,2,4,7,10-13H2,1,3H3;(H,3,4)(H,5,6)