7-chloranyl-2,2-dimethyl-4,5-dihydro-3H-1-benzoxepine-9-carboxylic acid

Systemtic Name: 7-chloranyl-2,2-dimethyl-4,5-dihydro-3H-1-benzoxepine-9-carboxylic acid Openeye Name: 7-chloro-2,2-dimethyl-4,5-dihydro-3H-1-benzoxepine-9-carboxylic acid CAS Name: 7-chloro-2,2-dimethyl-4,5-dihydro-3H-1-benzoxepin-9-carboxylic acid IUPAC Name: 7-chloro-2,2-dimethyl-4,5-dihydro-3H-1-benzoxepine-9-carboxylic acid Traditional Name: 7-chloro-2,2-dimethyl-4,5-dihydro-3H-1-benzoxepin-9-carboxylic acid Formula: C13H15ClO3 MolecularWeight: 254.7094

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC2=C(O1)C(=CC(=C2)Cl)C(=O)O)C

Isomeric SMILES

CC1(CCCC2=C(O1)C(=CC(=C2)Cl)C(=O)O)C

InChI

InChI=1S/C13H15ClO3/c1-13(2)5-3-4-8-6-9(14)7-10(12(15)16)11(8)17-13/h6-7H,3-5H2,1-2H3,(H,15,16)