N-[(E)-3-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-3-oxidanylidene-1-phenyl-prop-1-en-2-yl]benzamide

Systemtic Name: N-[(E)-3-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-3-oxidanylidene-1-phenyl-prop-1-en-2-yl]benzamide Openeye Name: N-[(E)-1-[4-(2-hydroxyethyl)piperazin-4-ium-1-carbonyl]-2-phenyl-vinyl]benzamide CAS Name: N-[(E)-3-[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-3-oxo-1-phenylprop-1-en-2-yl]benzamide IUPAC Name: N-[(E)-3-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-3-oxo-1-phenylprop-1-en-2-yl]benzamide Traditional Name: N-[(E)-1-[4-(2-hydroxyethyl)piperazin-4-ium-1-carbonyl]-2-phenyl-vinyl]benzamide Formula: C22H26N3O3+ MolecularWeight: 380.46014

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCO)C(=O)C(=CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CCO)C(=O)/C(=C\C2=CC=CC=C2)/NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H25N3O3/c26-16-15-24-11-13-25(14-12-24)22(28)20(17-18-7-3-1-4-8-18)23-21(27)19-9-5-2-6-10-19/h1-10,17,26H,11-16H2,(H,23,27)/p+1/b20-17+