4-chloranyl-1,2-dimethyl-6,11-dihydrobenzo[c][1]benzoxepine-11-carboxylic acid

Systemtic Name: 4-chloranyl-1,2-dimethyl-6,11-dihydrobenzo[c][1]benzoxepine-11-carboxylic acid Openeye Name: 4-chloro-1,2-dimethyl-6,11-dihydrobenzo[c][1]benzoxepine-11-carboxylic acid CAS Name: 4-chloro-1,2-dimethyl-6,11-dihydrobenzo[c][1]benzoxepin-11-carboxylic acid IUPAC Name: 4-chloro-1,2-dimethyl-6,11-dihydrobenzo[c][1]benzoxepine-11-carboxylic acid Traditional Name: 4-chloro-1,2-dimethyl-6,11-dihydrobenzo[c][1]benzoxepin-11-carboxylic acid Formula: C17H15ClO3 MolecularWeight: 302.7522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1C)C(C3=CC=CC=C3CO2)C(=O)O)Cl

Isomeric SMILES

CC1=CC(=C2C(=C1C)C(C3=CC=CC=C3CO2)C(=O)O)Cl

InChI

InChI=1S/C17H15ClO3/c1-9-7-13(18)16-14(10(9)2)15(17(19)20)12-6-4-3-5-11(12)8-21-16/h3-7,15H,8H2,1-2H3,(H,19,20)