2-(3,3-dimethyl-7-nitro-2H-1-benzoxepin-5-yl)-4-nitro-pyridine

Systemtic Name: 2-(3,3-dimethyl-7-nitro-2H-1-benzoxepin-5-yl)-4-nitro-pyridine Openeye Name: 2-(3,3-dimethyl-7-nitro-2H-1-benzoxepin-5-yl)-4-nitro-pyridine CAS Name: 2-(3,3-dimethyl-7-nitro-2H-1-benzoxepin-5-yl)-4-nitropyridine IUPAC Name: 2-(3,3-dimethyl-7-nitro-2H-1-benzoxepin-5-yl)-4-nitropyridine Traditional Name: 2-(3,3-dimethyl-7-nitro-2H-1-benzoxepin-5-yl)-4-nitro-pyridine Formula: C17H15N3O5 MolecularWeight: 341.3181

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=C(C=C2)[N+](=O)[O-])C(=C1)C3=NC=CC(=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1(COC2=C(C=C(C=C2)[N+](=O)[O-])C(=C1)C3=NC=CC(=C3)[N+](=O)[O-])C

InChI

InChI=1S/C17H15N3O5/c1-17(2)9-14(15-8-12(20(23)24)5-6-18-15)13-7-11(19(21)22)3-4-16(13)25-10-17/h3-9H,10H2,1-2H3