(2R,3S,5S,6R)-2,6-bis(4-nitrophenyl)-3,5-diphenyl-piperidin-1-ium-4-one

Systemtic Name: (2R,3S,5S,6R)-2,6-bis(4-nitrophenyl)-3,5-diphenyl-piperidin-1-ium-4-one Openeye Name: (2R,3S,5S,6R)-2,6-bis(4-nitrophenyl)-3,5-diphenyl-piperidin-1-ium-4-one CAS Name: (2R,3S,5S,6R)-2,6-bis(4-nitrophenyl)-3,5-diphenyl-4-piperidin-1-iumone IUPAC Name: (2R,3S,5S,6R)-2,6-bis(4-nitrophenyl)-3,5-diphenylpiperidin-1-ium-4-one Traditional Name: (2R,3S,5S,6R)-2,6-bis(4-nitrophenyl)-3,5-diphenyl-piperidin-1-ium-4-one Formula: C29H24N3O5+ MolecularWeight: 494.51796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C([NH2+]C(C(C2=O)C3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[C@H]2[C@@H]([NH2+][C@H]([C@@H](C2=O)C3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C29H23N3O5/c33-29-25(19-7-3-1-4-8-19)27(21-11-15-23(16-12-21)31(34)35)30-28(26(29)20-9-5-2-6-10-20)22-13-17-24(18-14-22)32(36)37/h1-18,25-28,30H/p+1/t25-,26-,27-,28-/m0/s1