N-[(Z)-3-oxidanylidene-3-(2-piperidin-1-ium-1-ylethylamino)-1-pyridin-3-yl-prop-1-en-2-yl]benzamide

Systemtic Name: N-[(Z)-3-oxidanylidene-3-(2-piperidin-1-ium-1-ylethylamino)-1-pyridin-3-yl-prop-1-en-2-yl]benzamide Openeye Name: N-[(Z)-1-(2-piperidin-1-ium-1-ylethylcarbamoyl)-2-(3-pyridyl)vinyl]benzamide CAS Name: N-[(Z)-3-oxo-3-[2-(1-piperidin-1-iumyl)ethylamino]-1-(3-pyridinyl)prop-1-en-2-yl]benzamide IUPAC Name: N-[(Z)-3-oxo-3-(2-piperidin-1-ium-1-ylethylamino)-1-pyridin-3-ylprop-1-en-2-yl]benzamide Traditional Name: N-[(Z)-1-(2-piperidin-1-ium-1-ylethylcarbamoyl)-2-(3-pyridyl)vinyl]benzamide Formula: C22H27N4O2+ MolecularWeight: 379.47538

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCNC(=O)C(=CC2=CN=CC=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](CC1)CCNC(=O)/C(=C/C2=CN=CC=C2)/NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H26N4O2/c27-21(19-9-3-1-4-10-19)25-20(16-18-8-7-11-23-17-18)22(28)24-12-15-26-13-5-2-6-14-26/h1,3-4,7-11,16-17H,2,5-6,12-15H2,(H,24,28)(H,25,27)/p+1/b20-16-