N-aminocarbonyl-2-[4-(phenylmethyl)-1,4-diazepan-4-ium-1-yl]ethanamide

Systemtic Name: N-aminocarbonyl-2-[4-(phenylmethyl)-1,4-diazepan-4-ium-1-yl]ethanamide Openeye Name: 2-(4-benzyl-1,4-diazepan-4-ium-1-yl)-N-carbamoyl-acetamide CAS Name: N-carbamoyl-2-[4-(phenylmethyl)-1,4-diazepan-4-ium-1-yl]acetamide IUPAC Name: 2-(4-benzyl-1,4-diazepan-4-ium-1-yl)-N-carbamoylacetamide Traditional Name: 2-(4-benzyl-1,4-diazepan-4-ium-1-yl)-N-carbamoyl-acetamide Formula: C15H23N4O2+ MolecularWeight: 291.36872

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCN(C1)CC(=O)NC(=O)N)CC2=CC=CC=C2

Isomeric SMILES

C1C[NH+](CCN(C1)CC(=O)NC(=O)N)CC2=CC=CC=C2

InChI

InChI=1S/C15H22N4O2/c16-15(21)17-14(20)12-19-8-4-7-18(9-10-19)11-13-5-2-1-3-6-13/h1-3,5-6H,4,7-12H2,(H3,16,17,20,21)/p+1