4-(2-oxidanylidene-1,4-dihydro-3,1-benzoxazin-5-yl)piperazine-1-carboxylic acid

Systemtic Name: 4-(2-oxidanylidene-1,4-dihydro-3,1-benzoxazin-5-yl)piperazine-1-carboxylic acid Openeye Name: 4-(2-oxo-1,4-dihydro-3,1-benzoxazin-5-yl)piperazine-1-carboxylic acid CAS Name: 4-(2-oxo-1,4-dihydro-3,1-benzoxazin-5-yl)-1-piperazinecarboxylic acid IUPAC Name: 4-(2-oxo-1,4-dihydro-3,1-benzoxazin-5-yl)piperazine-1-carboxylic acid Traditional Name: 4-(2-keto-1,4-dihydro-3,1-benzoxazin-5-yl)piperazine-1-carboxylic acid Formula: C13H15N3O4 MolecularWeight: 277.2759

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC3=C2COC(=O)N3)C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=CC3=C2COC(=O)N3)C(=O)O

InChI

InChI=1S/C13H15N3O4/c17-12-14-10-2-1-3-11(9(10)8-20-12)15-4-6-16(7-5-15)13(18)19/h1-3H,4-8H2,(H,14,17)(H,18,19)