3-[6-[(1R)-1-azanyl-2-methoxy-ethyl]-3-oxidanylidene-1,4-benzoxazin-4-yl]propanoic acid

Systemtic Name: 3-[6-[(1R)-1-azanyl-2-methoxy-ethyl]-3-oxidanylidene-1,4-benzoxazin-4-yl]propanoic acid Openeye Name: 3-[6-[(1R)-1-amino-2-methoxy-ethyl]-3-oxo-1,4-benzoxazin-4-yl]propanoic acid CAS Name: 3-[6-[(1R)-1-amino-2-methoxyethyl]-3-oxo-1,4-benzoxazin-4-yl]propanoic acid IUPAC Name: 3-[6-[(1R)-1-amino-2-methoxyethyl]-3-oxo-1,4-benzoxazin-4-yl]propanoic acid Traditional Name: 3-[6-[(1R)-1-amino-2-methoxy-ethyl]-3-keto-1,4-benzoxazin-4-yl]propionic acid Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

COCC(C1=CC2=C(C=C1)OCC(=O)N2CCC(=O)O)N

Isomeric SMILES

COC[C@@H](C1=CC2=C(C=C1)OCC(=O)N2CCC(=O)O)N

InChI

InChI=1S/C14H18N2O5/c1-20-7-10(15)9-2-3-12-11(6-9)16(5-4-14(18)19)13(17)8-21-12/h2-3,6,10H,4-5,7-8,15H2,1H3,(H,18,19)/t10-/m0/s1