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2-azanyl-3-[2,5-dimethyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]propanoic acid

2-azanyl-3-[2,5-dimethyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]propanoic acid

Systemtic Name:2-azanyl-3-[2,5-dimethyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]propanoic acid
Openeye Name:2-amino-3-(2,5-dimethyl-3,6-dioxo-cyclohexa-1,4-dien-1-yl)propanoic acid
CAS Name:2-amino-3-(2,5-dimethyl-3,6-dioxo-1-cyclohexa-1,4-dienyl)propanoic acid
IUPAC Name:2-amino-3-(2,5-dimethyl-3,6-dioxocyclohexa-1,4-dien-1-yl)propanoic acid
Traditional Name:2-amino-3-(3,6-diketo-2,5-dimethyl-cyclohexa-1,4-dien-1-yl)propionic acid
Formula: C11H13NO4
MolecularWeight: 223.22522
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(C1=O)CC(C(=O)O)N)C


Isomeric SMILES

CC1=CC(=O)C(=C(C1=O)CC(C(=O)O)N)C


InChI

InChI=1S/C11H13NO4/c1-5-3-9(13)6(2)7(10(5)14)4-8(12)11(15)16/h3,8H,4,12H2,1-2H3,(H,15,16)


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