4-bromanylbenzoic acid; N'-(2,4-dimethylphenyl)ethanimidamide

Systemtic Name: 4-bromanylbenzoic acid; N'-(2,4-dimethylphenyl)ethanimidamide Openeye Name: 4-bromobenzoic acid; N'-(2,4-dimethylphenyl)acetamidine CAS Name: 4-bromobenzoic acid; N'-(2,4-dimethylphenyl)ethanimidamide IUPAC Name: 4-bromobenzoic acid; N'-(2,4-dimethylphenyl)ethanimidamide Traditional Name: 4-bromobenzoic acid; N'-(2,4-dimethylphenyl)acetamidine Formula: C17H19BrN2O2 MolecularWeight: 363.24896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N=C(C)N)C.C1=CC(=CC=C1C(=O)O)Br

Isomeric SMILES

CC1=CC(=C(C=C1)N=C(C)N)C.C1=CC(=CC=C1C(=O)O)Br

InChI

InChI=1S/C10H14N2.C7H5BrO2/c1-7-4-5-10(8(2)6-7)12-9(3)11;8-6-3-1-5(2-4-6)7(9)10/h4-6H,1-3H3,(H2,11,12);1-4H,(H,9,10)