(2S)-1-[(3-methylphenyl)methyl]-N-(2-pyridin-3-yloxyphenyl)pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S)-1-[(3-methylphenyl)methyl]-N-(2-pyridin-3-yloxyphenyl)pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S)-1-(m-tolylmethyl)-N-[2-(3-pyridyloxy)phenyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2S)-1-[(3-methylphenyl)methyl]-N-[2-(3-pyridinyloxy)phenyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S)-1-[(3-methylphenyl)methyl]-N-(2-pyridin-3-yloxyphenyl)pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S)-1-(3-methylbenzyl)-N-[2-(3-pyridyloxy)phenyl]pyrrolidin-1-ium-2-carboxamide Formula: C24H26N3O2+ MolecularWeight: 388.48214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH+]2CCCC2C(=O)NC3=CC=CC=C3OC4=CN=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)C[NH+]2CCC[C@H]2C(=O)NC3=CC=CC=C3OC4=CN=CC=C4

InChI

InChI=1S/C24H25N3O2/c1-18-7-4-8-19(15-18)17-27-14-6-11-22(27)24(28)26-21-10-2-3-12-23(21)29-20-9-5-13-25-16-20/h2-5,7-10,12-13,15-16,22H,6,11,14,17H2,1H3,(H,26,28)/p+1/t22-/m0/s1