[(1R)-1-(4-ethylphenyl)-2-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-1-(4-ethylphenyl)-2-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]ethyl]-dimethyl-azanium Openeye Name: [(1R)-1-(4-ethylphenyl)-2-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]ethyl]-dimethyl-ammonium CAS Name: [(1R)-1-(4-ethylphenyl)-2-[[(E)-1-oxo-3-(1-phenyl-4-pyrazolyl)prop-2-enyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1R)-1-(4-ethylphenyl)-2-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]ethyl]-dimethylazanium Traditional Name: [(1R)-1-(4-ethylphenyl)-2-[[(E)-3-(1-phenylpyrazol-4-yl)acryloyl]amino]ethyl]-dimethyl-ammonium Formula: C24H29N4O+ MolecularWeight: 389.51326

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CNC(=O)C=CC2=CN(N=C2)C3=CC=CC=C3)[NH+](C)C

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](CNC(=O)/C=C/C2=CN(N=C2)C3=CC=CC=C3)[NH+](C)C

InChI

InChI=1S/C24H28N4O/c1-4-19-10-13-21(14-11-19)23(27(2)3)17-25-24(29)15-12-20-16-26-28(18-20)22-8-6-5-7-9-22/h5-16,18,23H,4,17H2,1-3H3,(H,25,29)/p+1/b15-12+/t23-/m0/s1