(2S)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-phenyl-butanamide

Systemtic Name: (2S)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-phenyl-butanamide Openeye Name: (2S)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-phenyl-butanamide CAS Name: (2S)-N-[(2R)-2-(2-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-2-phenylbutanamide IUPAC Name: (2S)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-2-phenylbutanamide Traditional Name: (2S)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-phenyl-butyramide Formula: C23H31N2O2+ MolecularWeight: 367.50444

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NCC(C2=CC=CC=C2OC)[NH+]3CCCC3

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)C(=O)NC[C@@H](C2=CC=CC=C2OC)[NH+]3CCCC3

InChI

InChI=1S/C23H30N2O2/c1-3-19(18-11-5-4-6-12-18)23(26)24-17-21(25-15-9-10-16-25)20-13-7-8-14-22(20)27-2/h4-8,11-14,19,21H,3,9-10,15-17H2,1-2H3,(H,24,26)/p+1/t19-,21-/m0/s1