7-bromanyl-1,8-dimethyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepine-3-carboxylic acid

Systemtic Name: 7-bromanyl-1,8-dimethyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepine-3-carboxylic acid Openeye Name: 7-bromo-1,8-dimethyl-2-oxo-4,5-dihydro-3H-1-benzazepine-3-carboxylic acid CAS Name: 7-bromo-1,8-dimethyl-2-oxo-4,5-dihydro-3H-1-benzazepine-3-carboxylic acid IUPAC Name: 7-bromo-1,8-dimethyl-2-oxo-4,5-dihydro-3H-1-benzazepine-3-carboxylic acid Traditional Name: 7-bromo-2-keto-1,8-dimethyl-4,5-dihydro-3H-1-benzazepine-3-carboxylic acid Formula: C13H14BrNO3 MolecularWeight: 312.15916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2CCC(C(=O)N(C2=C1)C)C(=O)O)Br

Isomeric SMILES

CC1=C(C=C2CCC(C(=O)N(C2=C1)C)C(=O)O)Br

InChI

InChI=1S/C13H14BrNO3/c1-7-5-11-8(6-10(7)14)3-4-9(13(17)18)12(16)15(11)2/h5-6,9H,3-4H2,1-2H3,(H,17,18)