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

Systemtic Name: 2-(7-butan-2-yl-3,3-dimethyl-2H-1-benzoxepin-5-yl)pyridine Openeye Name: 2-(3,3-dimethyl-7-sec-butyl-2H-1-benzoxepin-5-yl)pyridine CAS Name: 2-(7-butan-2-yl-3,3-dimethyl-2H-1-benzoxepin-5-yl)pyridine IUPAC Name: 2-(7-butan-2-yl-3,3-dimethyl-2H-1-benzoxepin-5-yl)pyridine Traditional Name: 2-(3,3-dimethyl-7-sec-butyl-2H-1-benzoxepin-5-yl)pyridine Formula: C21H25NO MolecularWeight: 307.4293

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)OCC(C=C2C3=CC=CC=N3)(C)C

Isomeric SMILES

CCC(C)C1=CC2=C(C=C1)OCC(C=C2C3=CC=CC=N3)(C)C

InChI

InChI=1S/C21H25NO/c1-5-15(2)16-9-10-20-17(12-16)18(13-21(3,4)14-23-20)19-8-6-7-11-22-19/h6-13,15H,5,14H2,1-4H3