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ethanedioic acid; 1-[4-(3-methyl-4-propan-2-yl-phenoxy)butyl]piperidine

ethanedioic acid; 1-[4-(3-methyl-4-propan-2-yl-phenoxy)butyl]piperidine

Systemtic Name:ethanedioic acid; 1-[4-(3-methyl-4-propan-2-yl-phenoxy)butyl]piperidine
Openeye Name:1-[4-(4-isopropyl-3-methyl-phenoxy)butyl]piperidine; oxalic acid
CAS Name:1-[4-(3-methyl-4-propan-2-ylphenoxy)butyl]piperidine; oxalic acid
IUPAC Name:1-[4-(3-methyl-4-propan-2-ylphenoxy)butyl]piperidine; oxalic acid
Traditional Name:1-[4-(4-isopropyl-3-methyl-phenoxy)butyl]piperidine; oxalic acid
Formula: C21H33NO5
MolecularWeight: 379.49042
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCCN2CCCCC2)C(C)C.C(=O)(C(=O)O)O


Isomeric SMILES

CC1=C(C=CC(=C1)OCCCCN2CCCCC2)C(C)C.C(=O)(C(=O)O)O


InChI

InChI=1S/C19H31NO.C2H2O4/c1-16(2)19-10-9-18(15-17(19)3)21-14-8-7-13-20-11-5-4-6-12-20;3-1(4)2(5)6/h9-10,15-16H,4-8,11-14H2,1-3H3;(H,3,4)(H,5,6)


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