[3-[(3-bromophenyl)methyl-ethyl-amino]-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-[(3-bromophenyl)methyl-ethyl-amino]-3-oxidanylidene-propyl]azanium Openeye Name: [3-[(3-bromophenyl)methyl-ethyl-amino]-3-oxo-propyl]ammonium CAS Name: [3-[(3-bromophenyl)methyl-ethylamino]-3-oxopropyl]ammonium IUPAC Name: [3-[(3-bromophenyl)methyl-ethylamino]-3-oxopropyl]azanium Traditional Name: [3-[(3-bromobenzyl)-ethyl-amino]-3-keto-propyl]ammonium Formula: C12H18BrN2O+ MolecularWeight: 286.18812

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=CC=C1)Br)C(=O)CC[NH3+]

Isomeric SMILES

CCN(CC1=CC(=CC=C1)Br)C(=O)CC[NH3+]

InChI

InChI=1S/C12H17BrN2O/c1-2-15(12(16)6-7-14)9-10-4-3-5-11(13)8-10/h3-5,8H,2,6-7,9,14H2,1H3/p+1