2-[[(E)-3-(2,3-dihydro-1-benzofuran-5-yl)prop-2-enoyl]amino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[[(E)-3-(2,3-dihydro-1-benzofuran-5-yl)prop-2-enoyl]amino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[[(E)-3-(2,3-dihydrobenzofuran-5-yl)prop-2-enoyl]amino]ethyl-diisopropyl-ammonium CAS Name: 2-[[(E)-3-(2,3-dihydrobenzofuran-5-yl)-1-oxoprop-2-enyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[(E)-3-(2,3-dihydro-1-benzofuran-5-yl)prop-2-enoyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[[(E)-3-coumaran-5-ylacryloyl]amino]ethyl-diisopropyl-ammonium Formula: C19H29N2O2+ MolecularWeight: 317.44576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNC(=O)C=CC1=CC2=C(C=C1)OCC2)C(C)C

Isomeric SMILES

CC(C)[NH+](CCNC(=O)/C=C/C1=CC2=C(C=C1)OCC2)C(C)C

InChI

InChI=1S/C19H28N2O2/c1-14(2)21(15(3)4)11-10-20-19(22)8-6-16-5-7-18-17(13-16)9-12-23-18/h5-8,13-15H,9-12H2,1-4H3,(H,20,22)/p+1/b8-6+