[2-(4-pyrrolidin-1-ium-1-ylbutanoylamino)phenyl]methylazanium

Systemtic Name: [2-(4-pyrrolidin-1-ium-1-ylbutanoylamino)phenyl]methylazanium Openeye Name: [2-(4-pyrrolidin-1-ium-1-ylbutanoylamino)phenyl]methylammonium CAS Name: [2-[[1-oxo-4-(1-pyrrolidin-1-iumyl)butyl]amino]phenyl]methylammonium IUPAC Name: [2-(4-pyrrolidin-1-ium-1-ylbutanoylamino)phenyl]methylazanium Traditional Name: [2-(4-pyrrolidin-1-ium-1-ylbutanoylamino)benzyl]ammonium Formula: C15H25N3O+2 MolecularWeight: 263.3785

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23N3O/c16-12-13-6-1-2-7-14(13)17-15(19)8-5-11-18-9-3-4-10-18/h1-2,6-7H,3-5,8-12,16H2,(H,17,19)/p+2