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ethanedioic acid; phenyl-[4-(4-piperidin-1-ylbutoxy)phenyl]methanone

ethanedioic acid; phenyl-[4-(4-piperidin-1-ylbutoxy)phenyl]methanone

Systemtic Name:ethanedioic acid; phenyl-[4-(4-piperidin-1-ylbutoxy)phenyl]methanone
Openeye Name:oxalic acid; phenyl-[4-[4-(1-piperidyl)butoxy]phenyl]methanone
CAS Name:oxalic acid; phenyl-[4-[4-(1-piperidinyl)butoxy]phenyl]methanone
IUPAC Name:oxalic acid; phenyl-[4-(4-piperidin-1-ylbutoxy)phenyl]methanone
Traditional Name:oxalic acid; phenyl-[4-(4-piperidinobutoxy)phenyl]methanone
Formula: C24H29NO6
MolecularWeight: 427.49016
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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCCOC2=CC=C(C=C2)C(=O)C3=CC=CC=C3.C(=O)(C(=O)O)O


Isomeric SMILES

C1CCN(CC1)CCCCOC2=CC=C(C=C2)C(=O)C3=CC=CC=C3.C(=O)(C(=O)O)O


InChI

InChI=1S/C22H27NO2.C2H2O4/c24-22(19-9-3-1-4-10-19)20-11-13-21(14-12-20)25-18-8-7-17-23-15-5-2-6-16-23;3-1(4)2(5)6/h1,3-4,9-14H,2,5-8,15-18H2;(H,3,4)(H,5,6)


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