1-(3-ethanoylphenyl)-3-[[1-(1-phenylethyl)pyrrolidin-1-ium-3-yl]methyl]urea

Systemtic Name: 1-(3-ethanoylphenyl)-3-[[1-(1-phenylethyl)pyrrolidin-1-ium-3-yl]methyl]urea Openeye Name: 1-(3-acetylphenyl)-3-[[1-(1-phenylethyl)pyrrolidin-1-ium-3-yl]methyl]urea CAS Name: 1-(3-acetylphenyl)-3-[[1-(1-phenylethyl)-3-pyrrolidin-1-iumyl]methyl]urea IUPAC Name: 1-(3-acetylphenyl)-3-[[1-(1-phenylethyl)pyrrolidin-1-ium-3-yl]methyl]urea Traditional Name: 1-(3-acetylphenyl)-3-[[1-(1-phenylethyl)pyrrolidin-1-ium-3-yl]methyl]urea Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH+]2CCC(C2)CNC(=O)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CC(C1=CC=CC=C1)[NH+]2CCC(C2)CNC(=O)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C22H27N3O2/c1-16(19-7-4-3-5-8-19)25-12-11-18(15-25)14-23-22(27)24-21-10-6-9-20(13-21)17(2)26/h3-10,13,16,18H,11-12,14-15H2,1-2H3,(H2,23,24,27)/p+1