N-[(2S)-3-(2-methylpropoxy)-2-pyrrolidin-1-ium-1-yl-propyl]-N-(phenylmethyl)aniline

Systemtic Name: N-[(2S)-3-(2-methylpropoxy)-2-pyrrolidin-1-ium-1-yl-propyl]-N-(phenylmethyl)aniline Openeye Name: N-benzyl-N-[(2S)-3-isobutoxy-2-pyrrolidin-1-ium-1-yl-propyl]aniline CAS Name: N-[(2S)-3-(2-methylpropoxy)-2-(1-pyrrolidin-1-iumyl)propyl]-N-(phenylmethyl)aniline IUPAC Name: N-benzyl-N-[(2S)-3-(2-methylpropoxy)-2-pyrrolidin-1-ium-1-ylpropyl]aniline Traditional Name: benzyl-[(2S)-3-isobutoxy-2-pyrrolidin-1-ium-1-yl-propyl]-phenyl-amine Formula: C24H35N2O+ MolecularWeight: 367.5475

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCC(CN(CC1=CC=CC=C1)C2=CC=CC=C2)[NH+]3CCCC3

Isomeric SMILES

CC(C)COC[C@H](CN(CC1=CC=CC=C1)C2=CC=CC=C2)[NH+]3CCCC3

InChI

InChI=1S/C24H34N2O/c1-21(2)19-27-20-24(25-15-9-10-16-25)18-26(23-13-7-4-8-14-23)17-22-11-5-3-6-12-22/h3-8,11-14,21,24H,9-10,15-20H2,1-2H3/p+1/t24-/m0/s1