1-[(3S)-5-oxidanylidene-1-phenyl-pyrrolidin-3-yl]-3-(3-pyrrolidin-1-ium-1-ylpropyl)urea

Systemtic Name: 1-[(3S)-5-oxidanylidene-1-phenyl-pyrrolidin-3-yl]-3-(3-pyrrolidin-1-ium-1-ylpropyl)urea Openeye Name: 1-[(3S)-5-oxo-1-phenyl-pyrrolidin-3-yl]-3-(3-pyrrolidin-1-ium-1-ylpropyl)urea CAS Name: 1-[(3S)-5-oxo-1-phenyl-3-pyrrolidinyl]-3-[3-(1-pyrrolidin-1-iumyl)propyl]urea IUPAC Name: 1-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-(3-pyrrolidin-1-ium-1-ylpropyl)urea Traditional Name: 1-[(3S)-5-keto-1-phenyl-pyrrolidin-3-yl]-3-(3-pyrrolidin-1-ium-1-ylpropyl)urea Formula: C18H27N4O2+ MolecularWeight: 331.43258

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCCNC(=O)NC2CC(=O)N(C2)C3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](C1)CCCNC(=O)N[C@H]2CC(=O)N(C2)C3=CC=CC=C3

InChI

InChI=1S/C18H26N4O2/c23-17-13-15(14-22(17)16-7-2-1-3-8-16)20-18(24)19-9-6-12-21-10-4-5-11-21/h1-3,7-8,15H,4-6,9-14H2,(H2,19,20,24)/p+1/t15-/m0/s1