N-[(2R)-2-(4-tert-butylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(2-methylpropoxy)benzamide

Systemtic Name: N-[(2R)-2-(4-tert-butylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(2-methylpropoxy)benzamide Openeye Name: N-[(2R)-2-(4-tert-butylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-isobutoxy-benzamide CAS Name: N-[(2R)-2-(4-tert-butylphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-4-(2-methylpropoxy)benzamide IUPAC Name: N-[(2R)-2-(4-tert-butylphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-4-(2-methylpropoxy)benzamide Traditional Name: N-[(2R)-2-(4-tert-butylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-isobutoxy-benzamide Formula: C27H39N2O2+ MolecularWeight: 423.61076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C(=O)NCC(C2=CC=C(C=C2)C(C)(C)C)[NH+]3CCCC3

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)C(=O)NC[C@@H](C2=CC=C(C=C2)C(C)(C)C)[NH+]3CCCC3

InChI

InChI=1S/C27H38N2O2/c1-20(2)19-31-24-14-10-22(11-15-24)26(30)28-18-25(29-16-6-7-17-29)21-8-12-23(13-9-21)27(3,4)5/h8-15,20,25H,6-7,16-19H2,1-5H3,(H,28,30)/p+1/t25-/m0/s1