2-[(4S)-2-(1,3-benzoxazol-2-ylamino)-5-oxidanylidene-1,4-dihydroimidazol-4-yl]ethanoate

Systemtic Name: 2-[(4S)-2-(1,3-benzoxazol-2-ylamino)-5-oxidanylidene-1,4-dihydroimidazol-4-yl]ethanoate Openeye Name: 2-[(4S)-2-(1,3-benzoxazol-2-ylamino)-5-oxo-1,4-dihydroimidazol-4-yl]acetate CAS Name: 2-[(4S)-2-(1,3-benzoxazol-2-ylamino)-5-oxo-1,4-dihydroimidazol-4-yl]acetate IUPAC Name: 2-[(4S)-2-(1,3-benzoxazol-2-ylamino)-5-oxo-1,4-dihydroimidazol-4-yl]acetate Traditional Name: 2-[(4S)-2-(1,3-benzoxazol-2-ylamino)-5-keto-2-imidazolin-4-yl]acetate Formula: C12H9N4O4- MolecularWeight: 273.22426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)NC3=NC(C(=O)N3)CC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)NC3=N[C@H](C(=O)N3)CC(=O)[O-]

InChI

InChI=1S/C12H10N4O4/c17-9(18)5-7-10(19)15-11(13-7)16-12-14-6-3-1-2-4-8(6)20-12/h1-4,7H,5H2,(H,17,18)(H2,13,14,15,16,19)/p-1/t7-/m0/s1