[2-(3-pyrrolidin-1-ium-1-ylpropanoylamino)phenyl]methylazanium

Systemtic Name: [2-(3-pyrrolidin-1-ium-1-ylpropanoylamino)phenyl]methylazanium Openeye Name: [2-(3-pyrrolidin-1-ium-1-ylpropanoylamino)phenyl]methylammonium CAS Name: [2-[[1-oxo-3-(1-pyrrolidin-1-iumyl)propyl]amino]phenyl]methylammonium IUPAC Name: [2-(3-pyrrolidin-1-ium-1-ylpropanoylamino)phenyl]methylazanium Traditional Name: [2-(3-pyrrolidin-1-ium-1-ylpropanoylamino)benzyl]ammonium Formula: C14H23N3O+2 MolecularWeight: 249.35192

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCC(=O)NC2=CC=CC=C2C[NH3+]

Isomeric SMILES

C1CC[NH+](C1)CCC(=O)NC2=CC=CC=C2C[NH3+]

InChI

InChI=1S/C14H21N3O/c15-11-12-5-1-2-6-13(12)16-14(18)7-10-17-8-3-4-9-17/h1-2,5-6H,3-4,7-11,15H2,(H,16,18)/p+2