7-methoxy-3,3-dimethyl-2H-1-benzoxepine-5-carbonitrile

Systemtic Name: 7-methoxy-3,3-dimethyl-2H-1-benzoxepine-5-carbonitrile Openeye Name: 7-methoxy-3,3-dimethyl-2H-1-benzoxepine-5-carbonitrile CAS Name: 7-methoxy-3,3-dimethyl-2H-1-benzoxepin-5-carbonitrile IUPAC Name: 7-methoxy-3,3-dimethyl-2H-1-benzoxepine-5-carbonitrile Traditional Name: 7-methoxy-3,3-dimethyl-2H-1-benzoxepin-5-carbonitrile Formula: C14H15NO2 MolecularWeight: 229.2744

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=C(C=C2)OC)C(=C1)C#N)C

Isomeric SMILES

CC1(COC2=C(C=C(C=C2)OC)C(=C1)C#N)C

InChI

InChI=1S/C14H15NO2/c1-14(2)7-10(8-15)12-6-11(16-3)4-5-13(12)17-9-14/h4-7H,9H2,1-3H3