(3S)-N-(3-cyclopentyloxyphenyl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-(3-cyclopentyloxyphenyl)piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-[3-(cyclopentoxy)phenyl]piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-(3-cyclopentyloxyphenyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-(3-cyclopentyloxyphenyl)piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-[3-(cyclopentoxy)phenyl]piperidin-1-ium-3-carboxamide Formula: C17H25N2O2+ MolecularWeight: 289.3926

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)OC2=CC=CC(=C2)NC(=O)C3CCC[NH2+]C3

Isomeric SMILES

C1CCC(C1)OC2=CC=CC(=C2)NC(=O)[C@H]3CCC[NH2+]C3

InChI

InChI=1S/C17H24N2O2/c20-17(13-5-4-10-18-12-13)19-14-6-3-9-16(11-14)21-15-7-1-2-8-15/h3,6,9,11,13,15,18H,1-2,4-5,7-8,10,12H2,(H,19,20)/p+1/t13-/m0/s1