N-(4-nitrophenyl)-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-(4-nitrophenyl)-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-carboxamide Openeye Name: 4-[(E)-cinnamyl]-N-(4-nitrophenyl)piperazin-4-ium-1-carboxamide CAS Name: N-(4-nitrophenyl)-4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-(4-nitrophenyl)-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-carboxamide Traditional Name: 4-[(E)-cinnamyl]-N-(4-nitrophenyl)piperazin-4-ium-1-carboxamide Formula: C20H23N4O3+ MolecularWeight: 367.42162

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC=CC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH+]1C/C=C/C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O3/c25-20(21-18-8-10-19(11-9-18)24(26)27)23-15-13-22(14-16-23)12-4-7-17-5-2-1-3-6-17/h1-11H,12-16H2,(H,21,25)/p+1/b7-4+