3-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[(E)-3-(4-tert-butylphenyl)-1-oxoprop-2-enyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]propyl-dimethylazanium Traditional Name: 3-[[(E)-3-(4-tert-butylphenyl)acryloyl]amino]propyl-dimethyl-ammonium Formula: C18H29N2O+ MolecularWeight: 289.43566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C=CC(=O)NCCC[NH+](C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)/C=C/C(=O)NCCC[NH+](C)C

InChI

InChI=1S/C18H28N2O/c1-18(2,3)16-10-7-15(8-11-16)9-12-17(21)19-13-6-14-20(4)5/h7-12H,6,13-14H2,1-5H3,(H,19,21)/p+1/b12-9+