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ethanedioic acid; 1-[1-(4-phenylcyclohexyl)piperidin-4-yl]azepane

ethanedioic acid; 1-[1-(4-phenylcyclohexyl)piperidin-4-yl]azepane

Systemtic Name:ethanedioic acid; 1-[1-(4-phenylcyclohexyl)piperidin-4-yl]azepane
Openeye Name:oxalic acid; 1-[1-(4-phenylcyclohexyl)-4-piperidyl]azepane
CAS Name:oxalic acid; 1-[1-(4-phenylcyclohexyl)-4-piperidinyl]azepane
IUPAC Name:oxalic acid; 1-[1-(4-phenylcyclohexyl)piperidin-4-yl]azepane
Traditional Name:oxalic acid; 1-[1-(4-phenylcyclohexyl)-4-piperidyl]azepane
Formula: C25H38N2O4
MolecularWeight: 430.58022
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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2CCN(CC2)C3CCC(CC3)C4=CC=CC=C4.C(=O)(C(=O)O)O


Isomeric SMILES

C1CCCN(CC1)C2CCN(CC2)C3CCC(CC3)C4=CC=CC=C4.C(=O)(C(=O)O)O


InChI

InChI=1S/C23H36N2.C2H2O4/c1-2-7-17-24(16-6-1)23-14-18-25(19-15-23)22-12-10-21(11-13-22)20-8-4-3-5-9-20;3-1(4)2(5)6/h3-5,8-9,21-23H,1-2,6-7,10-19H2;(H,3,4)(H,5,6)


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