1-(5-ethoxypyridin-2-yl)-4-nitro-2,5-dihydro-1,3,5-benzotriazepine

Systemtic Name: 1-(5-ethoxypyridin-2-yl)-4-nitro-2,5-dihydro-1,3,5-benzotriazepine Openeye Name: 1-(5-ethoxy-2-pyridyl)-4-nitro-2,5-dihydro-1,3,5-benzotriazepine CAS Name: 1-(5-ethoxy-2-pyridinyl)-4-nitro-2,5-dihydro-1,3,5-benzotriazepine IUPAC Name: 1-(5-ethoxypyridin-2-yl)-4-nitro-2,5-dihydro-1,3,5-benzotriazepine Traditional Name: 1-(5-ethoxy-2-pyridyl)-4-nitro-2,5-dihydro-1,3,5-benzotriazepine Formula: C15H15N5O3 MolecularWeight: 313.3113

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CN=C(C=C1)N2CN=C(NC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CN=C(C=C1)N2CN=C(NC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C15H15N5O3/c1-2-23-11-7-8-14(16-9-11)19-10-17-15(20(21)22)18-12-5-3-4-6-13(12)19/h3-9H,2,10H2,1H3,(H,17,18)