(E)-4-azanyl-2-(4-methylpiperazin-1-yl)-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-azanyl-2-(4-methylpiperazin-1-yl)-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-amino-2-(4-methylpiperazin-1-yl)-4-oxo-but-2-enoic acid CAS Name: (E)-4-amino-2-(4-methyl-1-piperazinyl)-4-oxo-2-butenoic acid IUPAC Name: (E)-4-amino-2-(4-methylpiperazin-1-yl)-4-oxobut-2-enoic acid Traditional Name: (E)-4-amino-4-keto-2-(4-methylpiperazino)but-2-enoic acid Formula: C9H15N3O3 MolecularWeight: 213.2337

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=CC(=O)N)C(=O)O

Isomeric SMILES

CN1CCN(CC1)/C(=C/C(=O)N)/C(=O)O

InChI

InChI=1S/C9H15N3O3/c1-11-2-4-12(5-3-11)7(9(14)15)6-8(10)13/h6H,2-5H2,1H3,(H2,10,13)(H,14,15)/b7-6+