2-[2-bromanyl-6-ethoxy-4-[(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylamino)methyl]phenoxy]ethanamide

Systemtic Name: 2-[2-bromanyl-6-ethoxy-4-[(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylamino)methyl]phenoxy]ethanamide Openeye Name: 2-[2-bromo-6-ethoxy-4-[(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylamino)methyl]phenoxy]acetamide CAS Name: 2-[2-bromo-6-ethoxy-4-[(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylamino)methyl]phenoxy]acetamide IUPAC Name: 2-[2-bromo-6-ethoxy-4-[(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylamino)methyl]phenoxy]acetamide Traditional Name: 2-[2-bromo-6-ethoxy-4-[(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylamino)methyl]phenoxy]acetamide Formula: C12H14BrN6O3- MolecularWeight: 370.18196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CNC2=NN=N[N-]2)Br)OCC(=O)N

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CNC2=NN=N[N-]2)Br)OCC(=O)N

InChI

InChI=1S/C12H15BrN6O3/c1-2-21-9-4-7(5-15-12-16-18-19-17-12)3-8(13)11(9)22-6-10(14)20/h3-4H,2,5-6H2,1H3,(H4,14,15,16,17,18,19,20)/p-1