[(2S,3S)-1-(4-methylphenyl)-5-oxidanylidene-3-(2-phenylmethoxyphenyl)pyrrolidin-2-yl]methylazanium

Systemtic Name: [(2S,3S)-1-(4-methylphenyl)-5-oxidanylidene-3-(2-phenylmethoxyphenyl)pyrrolidin-2-yl]methylazanium Openeye Name: [(2S,3S)-3-(2-benzyloxyphenyl)-5-oxo-1-(p-tolyl)pyrrolidin-2-yl]methylammonium CAS Name: [(2S,3S)-1-(4-methylphenyl)-5-oxo-3-(2-phenylmethoxyphenyl)-2-pyrrolidinyl]methylammonium IUPAC Name: [(2S,3S)-1-(4-methylphenyl)-5-oxo-3-(2-phenylmethoxyphenyl)pyrrolidin-2-yl]methylazanium Traditional Name: [(2S,3S)-3-(2-benzoxyphenyl)-5-keto-1-(p-tolyl)pyrrolidin-2-yl]methylammonium Formula: C25H27N2O2+ MolecularWeight: 387.49408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C(CC2=O)C3=CC=CC=C3OCC4=CC=CC=C4)C[NH3+]

Isomeric SMILES

CC1=CC=C(C=C1)N2[C@@H]([C@@H](CC2=O)C3=CC=CC=C3OCC4=CC=CC=C4)C[NH3+]

InChI

InChI=1S/C25H26N2O2/c1-18-11-13-20(14-12-18)27-23(16-26)22(15-25(27)28)21-9-5-6-10-24(21)29-17-19-7-3-2-4-8-19/h2-14,22-23H,15-17,26H2,1H3/p+1/t22-,23+/m0/s1