3-butan-2-yl-5,6-dihydrobenzo[b][1]benzoxepine-7,9-diol

Systemtic Name: 3-butan-2-yl-5,6-dihydrobenzo[b][1]benzoxepine-7,9-diol Openeye Name: 3-sec-butyl-5,6-dihydrobenzo[b][1]benzoxepine-7,9-diol CAS Name: 3-butan-2-yl-5,6-dihydrobenzo[b][1]benzoxepin-7,9-diol IUPAC Name: 3-butan-2-yl-5,6-dihydrobenzo[b][1]benzoxepine-7,9-diol Traditional Name: 3-sec-butyl-5,6-dihydrobenzo[b][1]benzoxepin-7,9-diol Formula: C18H20O3 MolecularWeight: 284.3496

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)OC3=CC(=CC(=C3CC2)O)O

Isomeric SMILES

CCC(C)C1=CC2=C(C=C1)OC3=CC(=CC(=C3CC2)O)O

InChI

InChI=1S/C18H20O3/c1-3-11(2)12-5-7-17-13(8-12)4-6-15-16(20)9-14(19)10-18(15)21-17/h5,7-11,19-20H,3-4,6H2,1-2H3