2-(4a,11a-dihydrobenzo[c][1]benzoxepin-2-yl)ethanoate

Systemtic Name: 2-(4a,11a-dihydrobenzo[c][1]benzoxepin-2-yl)ethanoate Openeye Name: 2-(4a,11a-dihydrobenzo[c][1]benzoxepin-2-yl)acetate CAS Name: 2-(4a,11a-dihydrobenzo[c][1]benzoxepin-2-yl)acetate IUPAC Name: 2-(4a,11a-dihydrobenzo[c][1]benzoxepin-2-yl)acetate Traditional Name: 2-(4a,11a-dihydrobenzo[c][1]benzoxepin-2-yl)acetate Formula: C16H13O3- MolecularWeight: 253.27262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC3C=C(C=CC3OC=C2C=C1)CC(=O)[O-]

Isomeric SMILES

C1=CC2=CC3C=C(C=CC3OC=C2C=C1)CC(=O)[O-]

InChI

InChI=1S/C16H14O3/c17-16(18)8-11-5-6-15-14(7-11)9-12-3-1-2-4-13(12)10-19-15/h1-7,9-10,14-15H,8H2,(H,17,18)/p-1