N-[(Z)-1-(4-fluorophenyl)-3-(2-morpholin-4-ium-4-ylethylamino)-3-oxidanylidene-prop-1-en-2-yl]-4-methyl-benzamide

Systemtic Name: N-[(Z)-1-(4-fluorophenyl)-3-(2-morpholin-4-ium-4-ylethylamino)-3-oxidanylidene-prop-1-en-2-yl]-4-methyl-benzamide Openeye Name: N-[(Z)-2-(4-fluorophenyl)-1-(2-morpholin-4-ium-4-ylethylcarbamoyl)vinyl]-4-methyl-benzamide CAS Name: N-[(Z)-1-(4-fluorophenyl)-3-[2-(4-morpholin-4-iumyl)ethylamino]-3-oxoprop-1-en-2-yl]-4-methylbenzamide IUPAC Name: N-[(Z)-1-(4-fluorophenyl)-3-(2-morpholin-4-ium-4-ylethylamino)-3-oxoprop-1-en-2-yl]-4-methylbenzamide Traditional Name: N-[(Z)-2-(4-fluorophenyl)-1-(2-morpholin-4-ium-4-ylethylcarbamoyl)vinyl]-4-methyl-benzamide Formula: C23H27FN3O3+ MolecularWeight: 412.477183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=CC2=CC=C(C=C2)F)C(=O)NCC[NH+]3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC=C(C=C2)F)/C(=O)NCC[NH+]3CCOCC3

InChI

InChI=1S/C23H26FN3O3/c1-17-2-6-19(7-3-17)22(28)26-21(16-18-4-8-20(24)9-5-18)23(29)25-10-11-27-12-14-30-15-13-27/h2-9,16H,10-15H2,1H3,(H,25,29)(H,26,28)/p+1/b21-16-