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

Systemtic Name: dimethyl-[(2S)-2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-2-phenyl-ethyl]azanium Openeye Name: dimethyl-[(2S)-2-phenyl-2-[[(E)-3-(p-tolyl)prop-2-enoyl]amino]ethyl]ammonium CAS Name: dimethyl-[(2S)-2-[[(E)-3-(4-methylphenyl)-1-oxoprop-2-enyl]amino]-2-phenylethyl]ammonium IUPAC Name: dimethyl-[(2S)-2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]-2-phenylethyl]azanium Traditional Name: dimethyl-[(2S)-2-phenyl-2-[[(E)-3-(p-tolyl)acryloyl]amino]ethyl]ammonium Formula: C20H25N2O+ MolecularWeight: 309.4253

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)NC(C[NH+](C)C)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)N[C@H](C[NH+](C)C)C2=CC=CC=C2

InChI

InChI=1S/C20H24N2O/c1-16-9-11-17(12-10-16)13-14-20(23)21-19(15-22(2)3)18-7-5-4-6-8-18/h4-14,19H,15H2,1-3H3,(H,21,23)/p+1/b14-13+/t19-/m1/s1