N-(3-morpholin-4-ium-4-ylpropyl)-2-[[(E)-3-phenylprop-2-enoyl]amino]benzamide

Systemtic Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-[[(E)-3-phenylprop-2-enoyl]amino]benzamide Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-[[(E)-3-phenylprop-2-enoyl]amino]benzamide CAS Name: N-[3-(4-morpholin-4-iumyl)propyl]-2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]benzamide IUPAC Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-[[(E)-3-phenylprop-2-enoyl]amino]benzamide Traditional Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-[[(E)-3-phenylacryloyl]amino]benzamide Formula: C23H28N3O3+ MolecularWeight: 394.48672

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C2=CC=CC=C2NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)C2=CC=CC=C2NC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C23H27N3O3/c27-22(12-11-19-7-2-1-3-8-19)25-21-10-5-4-9-20(21)23(28)24-13-6-14-26-15-17-29-18-16-26/h1-5,7-12H,6,13-18H2,(H,24,28)(H,25,27)/p+1/b12-11+