[2-[(3-bromophenyl)methyl-prop-2-enyl-amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[(3-bromophenyl)methyl-prop-2-enyl-amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[allyl-[(3-bromophenyl)methyl]amino]-2-oxo-ethyl]ammonium CAS Name: [2-[(3-bromophenyl)methyl-prop-2-enylamino]-2-oxoethyl]ammonium IUPAC Name: [2-[(3-bromophenyl)methyl-prop-2-enylamino]-2-oxoethyl]azanium Traditional Name: [2-[allyl-(3-bromobenzyl)amino]-2-keto-ethyl]ammonium Formula: C12H16BrN2O+ MolecularWeight: 284.17224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15BrN2O/c1-2-6-15(12(16)8-14)9-10-4-3-5-11(13)7-10/h2-5,7H,1,6,8-9,14H2/p+1