[(3S,4S)-3-[1,3-bis(oxidanylidene)isoindol-2-yl]-1-(diphenylmethyl)-4-methoxycarbonyl-azetidin-2-ylidene]-dimethyl-azanium perchlorate

Systemtic Name: [(3S,4S)-3-[1,3-bis(oxidanylidene)isoindol-2-yl]-1-(diphenylmethyl)-4-methoxycarbonyl-azetidin-2-ylidene]-dimethyl-azanium perchlorate Openeye Name: [(3S,4S)-1-benzhydryl-3-(1,3-dioxoisoindolin-2-yl)-4-methoxycarbonyl-azetidin-2-ylidene]-dimethyl-ammonium perchlorate CAS Name: [(3S,4S)-3-(1,3-dioxo-2-isoindolyl)-1-(diphenylmethyl)-4-methoxycarbonyl-2-azetidinylidene]-dimethylammonium perchlorate IUPAC Name: [(3S,4S)-1-benzhydryl-3-(1,3-dioxoisoindol-2-yl)-4-methoxycarbonylazetidin-2-ylidene]-dimethylazanium perchlorate Traditional Name: [(3S,4S)-1-benzhydryl-4-carbomethoxy-3-phthalimido-azetidin-2-ylidene]-dimethyl-ammonium perchlorate Formula: C28H26ClN3O8 MolecularWeight: 567.97434

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](=C1C(C(N1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC)N4C(=O)C5=CC=CC=C5C4=O)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C[N+](=C1[C@H]([C@H](N1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC)N4C(=O)C5=CC=CC=C5C4=O)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C28H26N3O4.ClHO4/c1-29(2)25-23(31-26(32)20-16-10-11-17-21(20)27(31)33)24(28(34)35-3)30(25)22(18-12-6-4-7-13-18)19-14-8-5-9-15-19;2-1(3,4)5/h4-17,22-24H,1-3H3;(H,2,3,4,5)/q+1;/p-1/t23-,24-;/m0./s1