3-ethylbenzo[b][1]benzoxepine-5-carboxylic acid

Systemtic Name: 3-ethylbenzo[b][1]benzoxepine-5-carboxylic acid Openeye Name: 3-ethylbenzo[b][1]benzoxepine-5-carboxylic acid CAS Name: 3-ethyl-5-benzo[b][1]benzoxepincarboxylic acid IUPAC Name: 3-ethylbenzo[b][1]benzoxepine-5-carboxylic acid Traditional Name: 3-ethylbenzo[b][1]benzoxepin-5-carboxylic acid Formula: C17H14O3 MolecularWeight: 266.29126

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC3=CC=CC=C3C=C2C(=O)O

Isomeric SMILES

CCC1=CC2=C(C=C1)OC3=CC=CC=C3C=C2C(=O)O

InChI

InChI=1S/C17H14O3/c1-2-11-7-8-16-13(9-11)14(17(18)19)10-12-5-3-4-6-15(12)20-16/h3-10H,2H2,1H3,(H,18,19)