N1-methyl-N4-[2-[2-[[(E)-[3-methyl-5,6-bis(oxidanylidene)cyclohex-2-en-1-ylidene]-oxidanyl-methyl]amino]ethylamino]ethyl]-2,3-bis(oxidanyl)benzene-1,4-dicarboxamide

Systemtic Name: N1-methyl-N4-[2-[2-[[(E)-[3-methyl-5,6-bis(oxidanylidene)cyclohex-2-en-1-ylidene]-oxidanyl-methyl]amino]ethylamino]ethyl]-2,3-bis(oxidanyl)benzene-1,4-dicarboxamide Openeye Name: 2,3-dihydroxy-N4-[2-[2-[[(E)-hydroxy-(3-methyl-5,6-dioxo-cyclohex-2-en-1-ylidene)methyl]amino]ethylamino]ethyl]-N1-methyl-terephthalamide CAS Name: 2,3-dihydroxy-N4-[2-[2-[[(E)-hydroxy-(3-methyl-5,6-dioxo-1-cyclohex-2-enylidene)methyl]amino]ethylamino]ethyl]-N1-methylbenzene-1,4-dicarboxamide IUPAC Name: 2,3-dihydroxy-4-N-[2-[2-[[(E)-hydroxy-(3-methyl-5,6-dioxocyclohex-2-en-1-ylidene)methyl]amino]ethylamino]ethyl]-1-N-methylbenzene-1,4-dicarboxamide Traditional Name: N'-[2-[2-[[(E)-(5,6-diketo-3-methyl-cyclohex-2-en-1-ylidene)-hydroxy-methyl]amino]ethylamino]ethyl]-2,3-dihydroxy-N-methyl-terephthalamide Formula: C21H26N4O7 MolecularWeight: 446.45374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(NCCNCCNC(=O)C2=C(C(=C(C=C2)C(=O)NC)O)O)O)C(=O)C(=O)C1

Isomeric SMILES

CC1=C/C(=C(/NCCNCCNC(=O)C2=C(C(=C(C=C2)C(=O)NC)O)O)\O)/C(=O)C(=O)C1

InChI

InChI=1S/C21H26N4O7/c1-11-9-14(16(27)15(26)10-11)21(32)25-8-6-23-5-7-24-20(31)13-4-3-12(19(30)22-2)17(28)18(13)29/h3-4,9,23,25,28-29,32H,5-8,10H2,1-2H3,(H,22,30)(H,24,31)/b21-14+