2-(7-bromanyl-2,2-dimethyl-1a,3-dihydrooxireno[2,3-d][1]benzoxepin-8b-yl)-1-oxidanidyl-pyridin-1-ium

Systemtic Name: 2-(7-bromanyl-2,2-dimethyl-1a,3-dihydrooxireno[2,3-d][1]benzoxepin-8b-yl)-1-oxidanidyl-pyridin-1-ium Openeye Name: 2-(7-bromo-2,2-dimethyl-1a,3-dihydrooxireno[2,3-d][1]benzoxepin-8b-yl)-1-oxido-pyridin-1-ium CAS Name: 2-(7-bromo-2,2-dimethyl-1a,3-dihydrooxireno[2,3-d][1]benzoxepin-8b-yl)-1-oxidopyridin-1-ium IUPAC Name: 2-(7-bromo-2,2-dimethyl-1a,3-dihydrooxireno[2,3-d][1]benzoxepin-8b-yl)-1-oxidopyridin-1-ium Traditional Name: 2-(7-bromo-2,2-dimethyl-1a,3-dihydrooxireno[2,3-d][1]benzoxepin-8b-yl)-1-oxido-pyridin-1-ium Formula: C17H16BrNO3 MolecularWeight: 362.21784

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=C(C=C2)Br)C3(C1O3)C4=CC=CC=[N+]4[O-])C

Isomeric SMILES

CC1(COC2=C(C=C(C=C2)Br)C3(C1O3)C4=CC=CC=[N+]4[O-])C

InChI

InChI=1S/C17H16BrNO3/c1-16(2)10-21-13-7-6-11(18)9-12(13)17(15(16)22-17)14-5-3-4-8-19(14)20/h3-9,15H,10H2,1-2H3