(2S)-1-methyl-N-[(1R)-1-phenylethyl]-1-(phenylmethyl)pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S)-1-methyl-N-[(1R)-1-phenylethyl]-1-(phenylmethyl)pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S)-1-benzyl-1-methyl-N-[(1R)-1-phenylethyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2S)-1-methyl-N-[(1R)-1-phenylethyl]-1-(phenylmethyl)-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S)-1-benzyl-1-methyl-N-[(1R)-1-phenylethyl]pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S)-1-benzyl-1-methyl-N-[(1R)-1-phenylethyl]pyrrolidin-1-ium-2-carboxamide Formula: C21H27N2O+ MolecularWeight: 323.45188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2CCC[N+]2(C)CC3=CC=CC=C3

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)[C@@H]2CCC[N+]2(C)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O/c1-17(19-12-7-4-8-13-19)22-21(24)20-14-9-15-23(20,2)16-18-10-5-3-6-11-18/h3-8,10-13,17,20H,9,14-16H2,1-2H3/p+1/t17-,20+,23?/m1/s1