1-[3-(4-butan-2-ylphenoxy)propyl]-3-methyl-piperidine; ethanedioic acid

Systemtic Name: 1-[3-(4-butan-2-ylphenoxy)propyl]-3-methyl-piperidine; ethanedioic acid Openeye Name: 3-methyl-1-[3-(4-sec-butylphenoxy)propyl]piperidine; oxalic acid CAS Name: 1-[3-(4-butan-2-ylphenoxy)propyl]-3-methylpiperidine; oxalic acid IUPAC Name: 1-[3-(4-butan-2-ylphenoxy)propyl]-3-methylpiperidine; oxalic acid Traditional Name: 3-methyl-1-[3-(4-sec-butylphenoxy)propyl]piperidine; oxalic acid Formula: C21H33NO5 MolecularWeight: 379.49042

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OCCCN2CCCC(C2)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)OCCCN2CCCC(C2)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H31NO.C2H2O4/c1-4-17(3)18-8-10-19(11-9-18)21-14-6-13-20-12-5-7-16(2)15-20;3-1(4)2(5)6/h8-11,16-17H,4-7,12-15H2,1-3H3;(H,3,4)(H,5,6)