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azocan-1-yl-[2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-5-methoxy-phenyl]methanone

azocan-1-yl-[2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-5-methoxy-phenyl]methanone

Systemtic Name:azocan-1-yl-[2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-5-methoxy-phenyl]methanone
Openeye Name:azocan-1-yl-[2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-5-methoxy-phenyl]methanone
CAS Name:1-azocanyl-[2-[(1-cyclopentyl-4-piperidin-1-iumyl)oxy]-5-methoxyphenyl]methanone
IUPAC Name:azocan-1-yl-[2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-5-methoxyphenyl]methanone
Traditional Name:azocan-1-yl-[2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-5-methoxy-phenyl]methanone
Formula: C25H39N2O3+
MolecularWeight: 415.58876
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC2CC[NH+](CC2)C3CCCC3)C(=O)N4CCCCCCC4


Isomeric SMILES

COC1=CC(=C(C=C1)OC2CC[NH+](CC2)C3CCCC3)C(=O)N4CCCCCCC4


InChI

InChI=1S/C25H38N2O3/c1-29-22-11-12-24(23(19-22)25(28)27-15-7-3-2-4-8-16-27)30-21-13-17-26(18-14-21)20-9-5-6-10-20/h11-12,19-21H,2-10,13-18H2,1H3/p+1


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