2-[2,3-bis(oxidanylidene)piperazin-1-yl]-5-(4-carbamimidoylphenoxy)-2-ethyl-pentanoic acid

Systemtic Name: 2-[2,3-bis(oxidanylidene)piperazin-1-yl]-5-(4-carbamimidoylphenoxy)-2-ethyl-pentanoic acid Openeye Name: 5-(4-carbamimidoylphenoxy)-2-(2,3-dioxopiperazin-1-yl)-2-ethyl-pentanoic acid CAS Name: 5-(4-carbamimidoylphenoxy)-2-(2,3-dioxo-1-piperazinyl)-2-ethylpentanoic acid IUPAC Name: 5-(4-carbamimidoylphenoxy)-2-(2,3-dioxopiperazin-1-yl)-2-ethylpentanoic acid Traditional Name: 5-(4-amidinophenoxy)-2-(2,3-diketopiperazino)-2-ethyl-valeric acid Formula: C18H24N4O5 MolecularWeight: 376.40696

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCOC1=CC=C(C=C1)C(=N)N)(C(=O)O)N2CCNC(=O)C2=O

Isomeric SMILES

CCC(CCCOC1=CC=C(C=C1)C(=N)N)(C(=O)O)N2CCNC(=O)C2=O

InChI

InChI=1S/C18H24N4O5/c1-2-18(17(25)26,22-10-9-21-15(23)16(22)24)8-3-11-27-13-6-4-12(5-7-13)14(19)20/h4-7H,2-3,8-11H2,1H3,(H3,19,20)(H,21,23)(H,25,26)