7-chloranyl-6-(dimethylamino)-2,3,4,5-tetrahydro-1,5-benzoxazepine-9-carboxylic acid

Systemtic Name: 7-chloranyl-6-(dimethylamino)-2,3,4,5-tetrahydro-1,5-benzoxazepine-9-carboxylic acid Openeye Name: 7-chloro-6-(dimethylamino)-2,3,4,5-tetrahydro-1,5-benzoxazepine-9-carboxylic acid CAS Name: 7-chloro-6-(dimethylamino)-2,3,4,5-tetrahydro-1,5-benzoxazepine-9-carboxylic acid IUPAC Name: 7-chloro-6-(dimethylamino)-2,3,4,5-tetrahydro-1,5-benzoxazepine-9-carboxylic acid Traditional Name: 7-chloro-6-(dimethylamino)-2,3,4,5-tetrahydro-1,5-benzoxazepine-9-carboxylic acid Formula: C12H15ClN2O3 MolecularWeight: 270.7121

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C2=C1NCCCO2)C(=O)O)Cl

Isomeric SMILES

CN(C)C1=C(C=C(C2=C1NCCCO2)C(=O)O)Cl

InChI

InChI=1S/C12H15ClN2O3/c1-15(2)10-8(13)6-7(12(16)17)11-9(10)14-4-3-5-18-11/h6,14H,3-5H2,1-2H3,(H,16,17)