1-[[4-(1-oxidanyl-2-phenyl-pyrrolidin-1-ium-1-yl)phenyl]methyl]urea

Systemtic Name: 1-[[4-(1-oxidanyl-2-phenyl-pyrrolidin-1-ium-1-yl)phenyl]methyl]urea Openeye Name: [4-(1-hydroxy-2-phenyl-pyrrolidin-1-ium-1-yl)phenyl]methylurea CAS Name: [4-(1-hydroxy-2-phenyl-1-pyrrolidin-1-iumyl)phenyl]methylurea IUPAC Name: [4-(1-hydroxy-2-phenylpyrrolidin-1-ium-1-yl)phenyl]methylurea Traditional Name: [4-(1-hydroxy-2-phenyl-pyrrolidin-1-ium-1-yl)benzyl]urea Formula: C18H22N3O2+ MolecularWeight: 312.38618

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([N+](C1)(C2=CC=C(C=C2)CNC(=O)N)O)C3=CC=CC=C3

Isomeric SMILES

C1CC([N+](C1)(C2=CC=C(C=C2)CNC(=O)N)O)C3=CC=CC=C3

InChI

InChI=1S/C18H21N3O2/c19-18(22)20-13-14-8-10-16(11-9-14)21(23)12-4-7-17(21)15-5-2-1-3-6-15/h1-3,5-6,8-11,17,23H,4,7,12-13H2,(H2-,19,20,22)/p+1