[(2S)-2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]-2-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(2S)-2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]-2-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(2S)-2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]-2-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(2S)-2-[[(E)-3-(4-bromophenyl)-1-oxoprop-2-enyl]amino]-2-phenylethyl]-dimethylammonium IUPAC Name: [(2S)-2-[[(E)-3-(4-bromophenyl)prop-2-enoyl]amino]-2-phenylethyl]-dimethylazanium Traditional Name: [(2S)-2-[[(E)-3-(4-bromophenyl)acryloyl]amino]-2-phenyl-ethyl]-dimethyl-ammonium Formula: C19H22BrN2O+ MolecularWeight: 374.29478

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC(C1=CC=CC=C1)NC(=O)C=CC2=CC=C(C=C2)Br

Isomeric SMILES

C[NH+](C)C[C@H](C1=CC=CC=C1)NC(=O)/C=C/C2=CC=C(C=C2)Br

InChI

InChI=1S/C19H21BrN2O/c1-22(2)14-18(16-6-4-3-5-7-16)21-19(23)13-10-15-8-11-17(20)12-9-15/h3-13,18H,14H2,1-2H3,(H,21,23)/p+1/b13-10+/t18-/m1/s1