2-(5-methyl-2-propan-2-yl-phenoxy)-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]ethanamide

Systemtic Name: 2-(5-methyl-2-propan-2-yl-phenoxy)-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]ethanamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-(2-isopropyl-5-methyl-phenoxy)acetamide CAS Name: 2-(5-methyl-2-propan-2-ylphenoxy)-N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-(5-methyl-2-propan-2-ylphenoxy)acetamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-(2-isopropyl-5-methyl-phenoxy)acetamide Formula: C23H31N2O2+ MolecularWeight: 367.50444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC2CC[NH+](C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(=O)N[C@H]2CC[NH+](C2)CC3=CC=CC=C3

InChI

InChI=1S/C23H30N2O2/c1-17(2)21-10-9-18(3)13-22(21)27-16-23(26)24-20-11-12-25(15-20)14-19-7-5-4-6-8-19/h4-10,13,17,20H,11-12,14-16H2,1-3H3,(H,24,26)/p+1/t20-/m0/s1