3-[4-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)phenyl]benzo[f]quinoline-1-carboxylate

Systemtic Name: 3-[4-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)phenyl]benzo[f]quinoline-1-carboxylate Openeye Name: 3-[4-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)phenyl]benzo[f]quinoline-1-carboxylate CAS Name: 3-[4-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)phenyl]-1-benzo[f]quinolinecarboxylate IUPAC Name: 3-[4-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)phenyl]benzo[f]quinoline-1-carboxylate Traditional Name: 3-[4-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)phenyl]benzo[f]quinoline-1-carboxylate Formula: C21H11N5O2-2 MolecularWeight: 365.34434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=N3)C4=CC=C(C=C4)C5=NN=N[N-]5)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=N3)C4=CC=C(C=C4)C5=NN=N[N-]5)C(=O)[O-]

InChI

InChI=1S/C21H13N5O2/c27-21(28)16-11-18(13-5-7-14(8-6-13)20-23-25-26-24-20)22-17-10-9-12-3-1-2-4-15(12)19(16)17/h1-11H,(H2,22,23,24,25,26,27,28)/p-2