N-[4-acetamido-2,5-bis(aziridin-1-yl)-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]ethanamide

Systemtic Name: N-[4-acetamido-2,5-bis(aziridin-1-yl)-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]ethanamide Openeye Name: N-[4-acetamido-2,5-bis(aziridin-1-yl)-3,6-dioxo-cyclohexa-1,4-dien-1-yl]acetamide CAS Name: N-[4-acetamido-2,5-bis(1-aziridinyl)-3,6-dioxo-1-cyclohexa-1,4-dienyl]acetamide IUPAC Name: N-[4-acetamido-2,5-bis(aziridin-1-yl)-3,6-dioxocyclohexa-1,4-dien-1-yl]acetamide Traditional Name: N-(4-acetamido-2,5-diethylenimino-3,6-diketo-cyclohexa-1,4-dien-1-yl)acetamide Formula: C14H16N4O4 MolecularWeight: 304.30124

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C(=O)C(=C(C1=O)N2CC2)NC(=O)C)N3CC3

Isomeric SMILES

CC(=O)NC1=C(C(=O)C(=C(C1=O)N2CC2)NC(=O)C)N3CC3

InChI

InChI=1S/C14H16N4O4/c1-7(19)15-9-11(17-3-4-17)14(22)10(16-8(2)20)12(13(9)21)18-5-6-18/h3-6H2,1-2H3,(H,15,19)(H,16,20)