[(3R,5S)-5-(2-methoxyethylcarbamoyl)-1-propan-2-yl-pyrrolidin-3-yl]-[(4-phenylmethoxyphenyl)methyl]azanium

Systemtic Name: [(3R,5S)-5-(2-methoxyethylcarbamoyl)-1-propan-2-yl-pyrrolidin-3-yl]-[(4-phenylmethoxyphenyl)methyl]azanium Openeye Name: (4-benzyloxyphenyl)methyl-[(3R,5S)-1-isopropyl-5-(2-methoxyethylcarbamoyl)pyrrolidin-3-yl]ammonium CAS Name: [(3R,5S)-5-[(2-methoxyethylamino)-oxomethyl]-1-propan-2-yl-3-pyrrolidinyl]-[(4-phenylmethoxyphenyl)methyl]ammonium IUPAC Name: [(3R,5S)-5-(2-methoxyethylcarbamoyl)-1-propan-2-ylpyrrolidin-3-yl]-[(4-phenylmethoxyphenyl)methyl]azanium Traditional Name: (4-benzoxybenzyl)-[(3R,5S)-1-isopropyl-5-(2-methoxyethylcarbamoyl)pyrrolidin-3-yl]ammonium Formula: C25H36N3O3+ MolecularWeight: 426.57164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CC(CC1C(=O)NCCOC)[NH2+]CC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)N1C[C@@H](C[C@H]1C(=O)NCCOC)[NH2+]CC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C25H35N3O3/c1-19(2)28-17-22(15-24(28)25(29)26-13-14-30-3)27-16-20-9-11-23(12-10-20)31-18-21-7-5-4-6-8-21/h4-12,19,22,24,27H,13-18H2,1-3H3,(H,26,29)/p+1/t22-,24+/m1/s1