ethyl 4-[5-[(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylamino)methyl]furan-2-yl]benzoate

Systemtic Name: ethyl 4-[5-[(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylamino)methyl]furan-2-yl]benzoate Openeye Name: ethyl 4-[5-[(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylamino)methyl]-2-furyl]benzoate CAS Name: 4-[5-[(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylamino)methyl]-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-[(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylamino)methyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylamino)methyl]-2-furyl]benzoic acid ethyl ester Formula: C15H14N5O3- MolecularWeight: 312.30336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)CNC3=NN=N[N-]3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)CNC3=NN=N[N-]3

InChI

InChI=1S/C15H14N5O3/c1-2-22-14(21)11-5-3-10(4-6-11)13-8-7-12(23-13)9-16-15-17-19-20-18-15/h3-8H,2,9H2,1H3,(H-,16,17,18,19,20)/q-1