(3R)-N-[4-methoxy-3-(2-methylpropoxy)phenyl]-1-(3-phenylpropyl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-N-[4-methoxy-3-(2-methylpropoxy)phenyl]-1-(3-phenylpropyl)piperidin-1-ium-3-carboxamide Openeye Name: (3R)-N-(3-isobutoxy-4-methoxy-phenyl)-1-(3-phenylpropyl)piperidin-1-ium-3-carboxamide CAS Name: (3R)-N-[4-methoxy-3-(2-methylpropoxy)phenyl]-1-(3-phenylpropyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-N-[4-methoxy-3-(2-methylpropoxy)phenyl]-1-(3-phenylpropyl)piperidin-1-ium-3-carboxamide Traditional Name: (3R)-N-(3-isobutoxy-4-methoxy-phenyl)-1-(3-phenylpropyl)piperidin-1-ium-3-carboxamide Formula: C26H37N2O3+ MolecularWeight: 425.58358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=CC(=C1)NC(=O)C2CCC[NH+](C2)CCCC3=CC=CC=C3)OC

Isomeric SMILES

CC(C)COC1=C(C=CC(=C1)NC(=O)[C@@H]2CCC[NH+](C2)CCCC3=CC=CC=C3)OC

InChI

InChI=1S/C26H36N2O3/c1-20(2)19-31-25-17-23(13-14-24(25)30-3)27-26(29)22-12-8-16-28(18-22)15-7-11-21-9-5-4-6-10-21/h4-6,9-10,13-14,17,20,22H,7-8,11-12,15-16,18-19H2,1-3H3,(H,27,29)/p+1/t22-/m1/s1