N-(3-methylbutyl)-1-[(2R)-2-phenylpropyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-(3-methylbutyl)-1-[(2R)-2-phenylpropyl]piperidin-1-ium-4-carboxamide Openeye Name: N-isopentyl-1-[(2R)-2-phenylpropyl]piperidin-1-ium-4-carboxamide CAS Name: N-(3-methylbutyl)-1-[(2R)-2-phenylpropyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-(3-methylbutyl)-1-[(2R)-2-phenylpropyl]piperidin-1-ium-4-carboxamide Traditional Name: N-isoamyl-1-[(2R)-2-phenylpropyl]piperidin-1-ium-4-carboxamide Formula: C20H33N2O+ MolecularWeight: 317.48882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1CC[NH+](CC1)CC(C)C2=CC=CC=C2

Isomeric SMILES

C[C@@H](C[NH+]1CCC(CC1)C(=O)NCCC(C)C)C2=CC=CC=C2

InChI

InChI=1S/C20H32N2O/c1-16(2)9-12-21-20(23)19-10-13-22(14-11-19)15-17(3)18-7-5-4-6-8-18/h4-8,16-17,19H,9-15H2,1-3H3,(H,21,23)/p+1/t17-/m0/s1