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

Systemtic Name: [3-(3-pyrrolidin-1-ium-1-ylpropanoylamino)phenyl]methylazanium Openeye Name: [3-(3-pyrrolidin-1-ium-1-ylpropanoylamino)phenyl]methylammonium CAS Name: [3-[[1-oxo-3-(1-pyrrolidin-1-iumyl)propyl]amino]phenyl]methylammonium IUPAC Name: [3-(3-pyrrolidin-1-ium-1-ylpropanoylamino)phenyl]methylazanium Traditional Name: [3-(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(=C2)C[NH3+]

Isomeric SMILES

C1CC[NH+](C1)CCC(=O)NC2=CC=CC(=C2)C[NH3+]

InChI

InChI=1S/C14H21N3O/c15-11-12-4-3-5-13(10-12)16-14(18)6-9-17-7-1-2-8-17/h3-5,10H,1-2,6-9,11,15H2,(H,16,18)/p+2