1,3-bis[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]urea

Systemtic Name: 1,3-bis[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]urea Openeye Name: 1,3-bis[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]urea CAS Name: 1,3-bis[(2R)-2-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]urea IUPAC Name: 1,3-bis[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-ylethyl]urea Traditional Name: 1,3-bis[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]urea Formula: C25H36N4O+2 MolecularWeight: 408.57954

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)NCC(C2=CC=CC=C2)[NH+]3CCCC3)C4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC(=O)NC[C@@H](C2=CC=CC=C2)[NH+]3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C25H34N4O/c30-25(26-19-23(28-15-7-8-16-28)21-11-3-1-4-12-21)27-20-24(29-17-9-10-18-29)22-13-5-2-6-14-22/h1-6,11-14,23-24H,7-10,15-20H2,(H2,26,27,30)/p+2/t23-,24-/m0/s1