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

Systemtic Name: [(2S,3S)-1-(2-methoxyphenyl)-5-oxidanylidene-3-(2-phenylmethoxyphenyl)pyrrolidin-2-yl]methylazanium Openeye Name: [(2S,3S)-3-(2-benzyloxyphenyl)-1-(2-methoxyphenyl)-5-oxo-pyrrolidin-2-yl]methylammonium CAS Name: [(2S,3S)-1-(2-methoxyphenyl)-5-oxo-3-(2-phenylmethoxyphenyl)-2-pyrrolidinyl]methylammonium IUPAC Name: [(2S,3S)-1-(2-methoxyphenyl)-5-oxo-3-(2-phenylmethoxyphenyl)pyrrolidin-2-yl]methylazanium Traditional Name: [(2S,3S)-3-(2-benzoxyphenyl)-5-keto-1-(2-methoxyphenyl)pyrrolidin-2-yl]methylammonium Formula: C25H27N2O3+ MolecularWeight: 403.49348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(C(CC2=O)C3=CC=CC=C3OCC4=CC=CC=C4)C[NH3+]

Isomeric SMILES

COC1=CC=CC=C1N2[C@@H]([C@@H](CC2=O)C3=CC=CC=C3OCC4=CC=CC=C4)C[NH3+]

InChI

InChI=1S/C25H26N2O3/c1-29-24-14-8-6-12-21(24)27-22(16-26)20(15-25(27)28)19-11-5-7-13-23(19)30-17-18-9-3-2-4-10-18/h2-14,20,22H,15-17,26H2,1H3/p+1/t20-,22+/m0/s1