1-cyclooctyl-N-[2-(3-methoxyphenyl)phenyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-cyclooctyl-N-[2-(3-methoxyphenyl)phenyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-cyclooctyl-N-[2-(3-methoxyphenyl)phenyl]piperidin-1-ium-4-carboxamide CAS Name: 1-cyclooctyl-N-[2-(3-methoxyphenyl)phenyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-cyclooctyl-N-[2-(3-methoxyphenyl)phenyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-cyclooctyl-N-[2-(3-methoxyphenyl)phenyl]piperidin-1-ium-4-carboxamide Formula: C27H37N2O2+ MolecularWeight: 421.59488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CC=CC=C2NC(=O)C3CC[NH+](CC3)C4CCCCCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC=CC=C2NC(=O)C3CC[NH+](CC3)C4CCCCCCC4

InChI

InChI=1S/C27H36N2O2/c1-31-24-13-9-10-22(20-24)25-14-7-8-15-26(25)28-27(30)21-16-18-29(19-17-21)23-11-5-3-2-4-6-12-23/h7-10,13-15,20-21,23H,2-6,11-12,16-19H2,1H3,(H,28,30)/p+1