N-[(2R)-2-(4-tert-butylphenyl)-2-piperidin-1-ium-1-yl-ethyl]-4-propan-2-yloxy-benzamide

Systemtic Name: N-[(2R)-2-(4-tert-butylphenyl)-2-piperidin-1-ium-1-yl-ethyl]-4-propan-2-yloxy-benzamide Openeye Name: N-[(2R)-2-(4-tert-butylphenyl)-2-piperidin-1-ium-1-yl-ethyl]-4-isopropoxy-benzamide CAS Name: N-[(2R)-2-(4-tert-butylphenyl)-2-(1-piperidin-1-iumyl)ethyl]-4-propan-2-yloxybenzamide IUPAC Name: N-[(2R)-2-(4-tert-butylphenyl)-2-piperidin-1-ium-1-ylethyl]-4-propan-2-yloxybenzamide Traditional Name: N-[(2R)-2-(4-tert-butylphenyl)-2-piperidin-1-ium-1-yl-ethyl]-4-isopropoxy-benzamide Formula: C27H39N2O2+ MolecularWeight: 423.61076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)NCC(C2=CC=C(C=C2)C(C)(C)C)[NH+]3CCCCC3

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)NC[C@@H](C2=CC=C(C=C2)C(C)(C)C)[NH+]3CCCCC3

InChI

InChI=1S/C27H38N2O2/c1-20(2)31-24-15-11-22(12-16-24)26(30)28-19-25(29-17-7-6-8-18-29)21-9-13-23(14-10-21)27(3,4)5/h9-16,20,25H,6-8,17-19H2,1-5H3,(H,28,30)/p+1/t25-/m0/s1