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

Systemtic Name: dimethyl-[(2S)-2-phenyl-2-[[(E)-3-(4-prop-2-enoxyphenyl)prop-2-enoyl]amino]ethyl]azanium Openeye Name: [(2S)-2-[[(E)-3-(4-allyloxyphenyl)prop-2-enoyl]amino]-2-phenyl-ethyl]-dimethyl-ammonium CAS Name: dimethyl-[(2S)-2-[[(E)-1-oxo-3-(4-prop-2-enoxyphenyl)prop-2-enyl]amino]-2-phenylethyl]ammonium IUPAC Name: dimethyl-[(2S)-2-phenyl-2-[[(E)-3-(4-prop-2-enoxyphenyl)prop-2-enoyl]amino]ethyl]azanium Traditional Name: [(2S)-2-[[(E)-3-(4-allyloxyphenyl)acryloyl]amino]-2-phenyl-ethyl]-dimethyl-ammonium Formula: C22H27N2O2+ MolecularWeight: 351.46198

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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)OCC=C

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O2/c1-4-16-26-20-13-10-18(11-14-20)12-15-22(25)23-21(17-24(2)3)19-8-6-5-7-9-19/h4-15,21H,1,16-17H2,2-3H3,(H,23,25)/p+1/b15-12+/t21-/m1/s1