(E)-N-[3-chloranyl-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[3-chloranyl-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[3-chloro-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[3-chloro-4-(4-ethyl-1-piperazin-4-iumyl)phenyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[3-chloro-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[3-chloro-4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-phenyl-acrylamide Formula: C21H25ClN3O+ MolecularWeight: 370.8957

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C=CC3=CC=CC=C3)Cl

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)/C=C/C3=CC=CC=C3)Cl

InChI

InChI=1S/C21H24ClN3O/c1-2-24-12-14-25(15-13-24)20-10-9-18(16-19(20)22)23-21(26)11-8-17-6-4-3-5-7-17/h3-11,16H,2,12-15H2,1H3,(H,23,26)/p+1/b11-8+