(4-bromophenyl)methyl-cyclopropyl-[2-oxidanylidene-2-(prop-2-ynylamino)ethyl]azanium

Systemtic Name: (4-bromophenyl)methyl-cyclopropyl-[2-oxidanylidene-2-(prop-2-ynylamino)ethyl]azanium Openeye Name: (4-bromophenyl)methyl-cyclopropyl-[2-oxo-2-(prop-2-ynylamino)ethyl]ammonium CAS Name: (4-bromophenyl)methyl-cyclopropyl-[2-oxo-2-(prop-2-ynylamino)ethyl]ammonium IUPAC Name: (4-bromophenyl)methyl-cyclopropyl-[2-oxo-2-(prop-2-ynylamino)ethyl]azanium Traditional Name: (4-bromobenzyl)-cyclopropyl-[2-keto-2-(propargylamino)ethyl]ammonium Formula: C15H18BrN2O+ MolecularWeight: 322.22022

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)C[NH+](CC1=CC=C(C=C1)Br)C2CC2

Isomeric SMILES

C#CCNC(=O)C[NH+](CC1=CC=C(C=C1)Br)C2CC2

InChI

InChI=1S/C15H17BrN2O/c1-2-9-17-15(19)11-18(14-7-8-14)10-12-3-5-13(16)6-4-12/h1,3-6,14H,7-11H2,(H,17,19)/p+1