N-(4-cyanophenyl)-2-[4-(2-morpholin-4-ium-4-ylethanoyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-cyanophenyl)-2-[4-(2-morpholin-4-ium-4-ylethanoyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(4-cyanophenyl)-2-[4-(2-morpholin-4-ium-4-ylacetyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-cyanophenyl)-2-[4-[2-(4-morpholin-4-iumyl)-1-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-cyanophenyl)-2-[4-(2-morpholin-4-ium-4-ylacetyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(4-cyanophenyl)-2-[4-(2-morpholin-4-ium-4-ylacetyl)piperazin-1-ium-1-yl]acetamide Formula: C19H27N5O3+2 MolecularWeight: 373.44938

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=C(C=C2)C#N)C(=O)C[NH+]3CCOCC3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=C(C=C2)C#N)C(=O)C[NH+]3CCOCC3

InChI

InChI=1S/C19H25N5O3/c20-13-16-1-3-17(4-2-16)21-18(25)14-22-5-7-24(8-6-22)19(26)15-23-9-11-27-12-10-23/h1-4H,5-12,14-15H2,(H,21,25)/p+2