[(3S,5S)-5-(methylcarbamoyl)-1-propan-2-yl-pyrrolidin-3-yl]-[(4-phenylphenyl)methyl]azanium

Systemtic Name: [(3S,5S)-5-(methylcarbamoyl)-1-propan-2-yl-pyrrolidin-3-yl]-[(4-phenylphenyl)methyl]azanium Openeye Name: [(3S,5S)-1-isopropyl-5-(methylcarbamoyl)pyrrolidin-3-yl]-[(4-phenylphenyl)methyl]ammonium CAS Name: [(3S,5S)-5-(methylcarbamoyl)-1-propan-2-yl-3-pyrrolidinyl]-[(4-phenylphenyl)methyl]ammonium IUPAC Name: [(3S,5S)-5-(methylcarbamoyl)-1-propan-2-ylpyrrolidin-3-yl]-[(4-phenylphenyl)methyl]azanium Traditional Name: [(3S,5S)-1-isopropyl-5-(methylcarbamoyl)pyrrolidin-3-yl]-(4-phenylbenzyl)ammonium Formula: C22H30N3O+ MolecularWeight: 352.4931

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O/c1-16(2)25-15-20(13-21(25)22(26)23-3)24-14-17-9-11-19(12-10-17)18-7-5-4-6-8-18/h4-12,16,20-21,24H,13-15H2,1-3H3,(H,23,26)/p+1/t20-,21-/m0/s1