2-[[(E)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]butanedioic acid

Systemtic Name: 2-[[(E)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]butanedioic acid Openeye Name: 2-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]butanedioic acid CAS Name: 2-[[(E)-(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]butanedioic acid IUPAC Name: 2-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]butanedioic acid Traditional Name: 2-[[(E)-(6-ketocyclohexa-2,4-dien-1-ylidene)methyl]amino]succinic acid Formula: C11H11NO5 MolecularWeight: 237.20874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CNC(CC(=O)O)C(=O)O)C(=O)C=C1

Isomeric SMILES

C1=C/C(=C\NC(CC(=O)O)C(=O)O)/C(=O)C=C1

InChI

InChI=1S/C11H11NO5/c13-9-4-2-1-3-7(9)6-12-8(11(16)17)5-10(14)15/h1-4,6,8,12H,5H2,(H,14,15)(H,16,17)/b7-6+