N,N-diethyl-4-[2-[4-(phenylmethyl)pyridin-1-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: N,N-diethyl-4-[2-[4-(phenylmethyl)pyridin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: 4-[[2-(4-benzylpyridin-1-ium-1-yl)acetyl]amino]-N,N-diethyl-benzamide CAS Name: N,N-diethyl-4-[[1-oxo-2-[4-(phenylmethyl)-1-pyridin-1-iumyl]ethyl]amino]benzamide IUPAC Name: 4-[[2-(4-benzylpyridin-1-ium-1-yl)acetyl]amino]-N,N-diethylbenzamide Traditional Name: 4-[[2-(4-benzylpyridin-1-ium-1-yl)acetyl]amino]-N,N-diethyl-benzamide Formula: C25H28N3O2+ MolecularWeight: 402.50872

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)C[N+]2=CC=C(C=C2)CC3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)C[N+]2=CC=C(C=C2)CC3=CC=CC=C3

InChI

InChI=1S/C25H27N3O2/c1-3-28(4-2)25(30)22-10-12-23(13-11-22)26-24(29)19-27-16-14-21(15-17-27)18-20-8-6-5-7-9-20/h5-17H,3-4,18-19H2,1-2H3/p+1