[2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(E)-3-phenylprop-2-enyl]azanium

Systemtic Name: [2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(E)-3-phenylprop-2-enyl]azanium Openeye Name: [(E)-cinnamyl]-[2-(3,4-diethoxyanilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-(3,4-diethoxyanilino)-2-oxoethyl]-methyl-[(E)-3-phenylprop-2-enyl]ammonium IUPAC Name: [2-(3,4-diethoxyanilino)-2-oxoethyl]-methyl-[(E)-3-phenylprop-2-enyl]azanium Traditional Name: [(E)-cinnamyl]-[2-(3,4-diethoxyanilino)-2-keto-ethyl]-methyl-ammonium Formula: C22H29N2O3+ MolecularWeight: 369.47726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C[NH+](C)CC=CC2=CC=CC=C2)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C[NH+](C)C/C=C/C2=CC=CC=C2)OCC

InChI

InChI=1S/C22H28N2O3/c1-4-26-20-14-13-19(16-21(20)27-5-2)23-22(25)17-24(3)15-9-12-18-10-7-6-8-11-18/h6-14,16H,4-5,15,17H2,1-3H3,(H,23,25)/p+1/b12-9+