2-[2-(azocan-1-ium-1-yl)ethanoylamino]-N-(phenylmethyl)benzamide

Systemtic Name: 2-[2-(azocan-1-ium-1-yl)ethanoylamino]-N-(phenylmethyl)benzamide Openeye Name: 2-[[2-(azocan-1-ium-1-yl)acetyl]amino]-N-benzyl-benzamide CAS Name: 2-[[2-(1-azocan-1-iumyl)-1-oxoethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: 2-[[2-(azocan-1-ium-1-yl)acetyl]amino]-N-benzylbenzamide Traditional Name: 2-[[2-(azocan-1-ium-1-yl)acetyl]amino]-N-benzyl-benzamide Formula: C23H30N3O2+ MolecularWeight: 380.5032

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CCC1)CC(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CCC[NH+](CCC1)CC(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C23H29N3O2/c27-22(18-26-15-9-2-1-3-10-16-26)25-21-14-8-7-13-20(21)23(28)24-17-19-11-5-4-6-12-19/h4-8,11-14H,1-3,9-10,15-18H2,(H,24,28)(H,25,27)/p+1