2-ethoxy-2-oxidanylidene-ethanoic acid; ethyl 3-(benzotriazol-1-yl)-2-oxidanylidene-propanoate

Systemtic Name: 2-ethoxy-2-oxidanylidene-ethanoic acid; ethyl 3-(benzotriazol-1-yl)-2-oxidanylidene-propanoate Openeye Name: 2-ethoxy-2-oxo-acetic acid; ethyl 3-(benzotriazol-1-yl)-2-oxo-propanoate CAS Name: 3-(1-benzotriazolyl)-2-oxopropanoic acid ethyl ester; 2-ethoxy-2-oxoacetic acid IUPAC Name: 2-ethoxy-2-oxoacetic acid; ethyl 3-(benzotriazol-1-yl)-2-oxopropanoate Traditional Name: 3-(benzotriazol-1-yl)-2-keto-propionic acid ethyl ester; 2-ethoxy-2-keto-acetic acid Formula: C15H17N3O7 MolecularWeight: 351.31138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)CN1C2=CC=CC=C2N=N1.CCOC(=O)C(=O)O

Isomeric SMILES

CCOC(=O)C(=O)CN1C2=CC=CC=C2N=N1.CCOC(=O)C(=O)O

InChI

InChI=1S/C11H11N3O3.C4H6O4/c1-2-17-11(16)10(15)7-14-9-6-4-3-5-8(9)12-13-14;1-2-8-4(7)3(5)6/h3-6H,2,7H2,1H3;2H2,1H3,(H,5,6)