4-ethoxy-1-(6-nitropyridin-3-yl)-2,5-dihydro-1,3,5-benzotriazepine

Systemtic Name: 4-ethoxy-1-(6-nitropyridin-3-yl)-2,5-dihydro-1,3,5-benzotriazepine Openeye Name: 4-ethoxy-1-(6-nitro-3-pyridyl)-2,5-dihydro-1,3,5-benzotriazepine CAS Name: 4-ethoxy-1-(6-nitro-3-pyridinyl)-2,5-dihydro-1,3,5-benzotriazepine IUPAC Name: 4-ethoxy-1-(6-nitropyridin-3-yl)-2,5-dihydro-1,3,5-benzotriazepine Traditional Name: 4-ethoxy-1-(6-nitro-3-pyridyl)-2,5-dihydro-1,3,5-benzotriazepine Formula: C15H15N5O3 MolecularWeight: 313.3113

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NCN(C2=CC=CC=C2N1)C3=CN=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=NCN(C2=CC=CC=C2N1)C3=CN=C(C=C3)[N+](=O)[O-]

InChI

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