N-[4-(3-methoxyphenyl)-2,5-bis(oxidanylidene)piperazin-1-yl]-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[4-(3-methoxyphenyl)-2,5-bis(oxidanylidene)piperazin-1-yl]-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-[4-(3-methoxyphenyl)-2,5-dioxo-piperazin-1-yl]-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[4-(3-methoxyphenyl)-2,5-dioxo-1-piperazinyl]-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-[4-(3-methoxyphenyl)-2,5-dioxopiperazin-1-yl]-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-[2,5-diketo-4-(3-methoxyphenyl)piperazino]-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C17H23N4O4+ MolecularWeight: 347.38892

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CC(=O)N(CC2=O)NC(=O)C[NH+]3CCCC3

Isomeric SMILES

COC1=CC=CC(=C1)N2CC(=O)N(CC2=O)NC(=O)C[NH+]3CCCC3

InChI

InChI=1S/C17H22N4O4/c1-25-14-6-4-5-13(9-14)20-11-17(24)21(12-16(20)23)18-15(22)10-19-7-2-3-8-19/h4-6,9H,2-3,7-8,10-12H2,1H3,(H,18,22)/p+1