ethyl 3-[4-methyl-2-oxidanylidene-7-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylmethoxy)chromen-3-yl]propanoate

Systemtic Name: ethyl 3-[4-methyl-2-oxidanylidene-7-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylmethoxy)chromen-3-yl]propanoate Openeye Name: ethyl 3-[4-methyl-2-oxo-7-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylmethoxy)chromen-3-yl]propanoate CAS Name: 3-[4-methyl-2-oxo-7-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylmethoxy)-1-benzopyran-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-methyl-2-oxo-7-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylmethoxy)chromen-3-yl]propanoate Traditional Name: 3-[2-keto-4-methyl-7-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylmethoxy)chromen-3-yl]propionic acid ethyl ester Formula: C17H17N4O5- MolecularWeight: 357.34068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(C2=C(C=C(C=C2)OCC3=NN=N[N-]3)OC1=O)C

Isomeric SMILES

CCOC(=O)CCC1=C(C2=C(C=C(C=C2)OCC3=NN=N[N-]3)OC1=O)C

InChI

InChI=1S/C17H17N4O5/c1-3-24-16(22)7-6-13-10(2)12-5-4-11(8-14(12)26-17(13)23)25-9-15-18-20-21-19-15/h4-5,8H,3,6-7,9H2,1-2H3/q-1