[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-(2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-(2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 2-(2-oxo-1,3-benzoxazol-3-yl)acetate CAS Name: 2-(2-oxo-1,3-benzoxazol-3-yl)acetic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 2-(2-oxo-1,3-benzoxazol-3-yl)acetate Traditional Name: 2-(2-keto-1,3-benzoxazol-3-yl)acetic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C14H13N3O5 MolecularWeight: 303.27012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=O)O2)CC(=O)OCC(=O)NCCC#N

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=O)O2)CC(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C14H13N3O5/c15-6-3-7-16-12(18)9-21-13(19)8-17-10-4-1-2-5-11(10)22-14(17)20/h1-2,4-5H,3,7-9H2,(H,16,18)