2-bromanyl-10-methyl-6,11-dihydrobenzo[c][1]benzoxepine-11-carboxylic acid

Systemtic Name: 2-bromanyl-10-methyl-6,11-dihydrobenzo[c][1]benzoxepine-11-carboxylic acid Openeye Name: 2-bromo-10-methyl-6,11-dihydrobenzo[c][1]benzoxepine-11-carboxylic acid CAS Name: 2-bromo-10-methyl-6,11-dihydrobenzo[c][1]benzoxepin-11-carboxylic acid IUPAC Name: 2-bromo-10-methyl-6,11-dihydrobenzo[c][1]benzoxepine-11-carboxylic acid Traditional Name: 2-bromo-10-methyl-6,11-dihydrobenzo[c][1]benzoxepin-11-carboxylic acid Formula: C16H13BrO3 MolecularWeight: 333.17662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C(C3=C(C=CC(=C3)Br)OC2)C(=O)O

Isomeric SMILES

CC1=CC=CC2=C1C(C3=C(C=CC(=C3)Br)OC2)C(=O)O

InChI

InChI=1S/C16H13BrO3/c1-9-3-2-4-10-8-20-13-6-5-11(17)7-12(13)15(14(9)10)16(18)19/h2-7,15H,8H2,1H3,(H,18,19)