spiro[6H-benzo[c][1]benzoxepine-11,2'-oxirane]-2-carbonitrile

Systemtic Name: spiro[6H-benzo[c][1]benzoxepine-11,2'-oxirane]-2-carbonitrile Openeye Name: spiro[6H-benzo[c][1]benzoxepine-11,2'-oxirane]-2-carbonitrile CAS Name: 2-spiro[6H-benzo[c][1]benzoxepin-11,2'-oxirane]carbonitrile IUPAC Name: spiro[6H-benzo[c][1]benzoxepine-11,2'-oxirane]-2-carbonitrile Traditional Name: spiro[6H-benzo[c][1]benzoxepin-11,2'-oxirane]-2-carbonitrile Formula: C16H11NO2 MolecularWeight: 249.26404

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C3(CO3)C4=C(O1)C=CC(=C4)C#N

Isomeric SMILES

C1C2=CC=CC=C2C3(CO3)C4=C(O1)C=CC(=C4)C#N

InChI

InChI=1S/C16H11NO2/c17-8-11-5-6-15-14(7-11)16(10-19-16)13-4-2-1-3-12(13)9-18-15/h1-7H,9-10H2