7-chloranyl-5-(4-nitrophenyl)-2-pyridin-4-yl-4H-1,3,4-benzotriazepine

Systemtic Name: 7-chloranyl-5-(4-nitrophenyl)-2-pyridin-4-yl-4H-1,3,4-benzotriazepine Openeye Name: 7-chloro-5-(4-nitrophenyl)-2-(4-pyridyl)-4H-1,3,4-benzotriazepine CAS Name: 7-chloro-5-(4-nitrophenyl)-2-pyridin-4-yl-4H-1,3,4-benzotriazepine IUPAC Name: 7-chloro-5-(4-nitrophenyl)-2-pyridin-4-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-chloro-5-(4-nitrophenyl)-2-(4-pyridyl)-4H-1,3,4-benzotriazepine Formula: C19H12ClN5O2 MolecularWeight: 377.78388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C3C=C(C=CC3=NC(=NN2)C4=CC=NC=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=C3C=C(C=CC3=NC(=NN2)C4=CC=NC=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H12ClN5O2/c20-14-3-6-17-16(11-14)18(12-1-4-15(5-2-12)25(26)27)23-24-19(22-17)13-7-9-21-10-8-13/h1-11,23H