benzenecarbonitrile; 2-bromanyl-4-[(imidazol-1-ylamino)methyl]phenol

Systemtic Name: benzenecarbonitrile; 2-bromanyl-4-[(imidazol-1-ylamino)methyl]phenol Openeye Name: benzonitrile; 2-bromo-4-[(imidazol-1-ylamino)methyl]phenol CAS Name: benzonitrile; 2-bromo-4-[(1-imidazolylamino)methyl]phenol IUPAC Name: benzonitrile; 2-bromo-4-[(imidazol-1-ylamino)methyl]phenol Traditional Name: benzonitrile; 2-bromo-4-[(imidazol-1-ylamino)methyl]phenol Formula: C17H15BrN4O MolecularWeight: 371.2312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#N.C1=CC(=C(C=C1CNN2C=CN=C2)Br)O

Isomeric SMILES

C1=CC=C(C=C1)C#N.C1=CC(=C(C=C1CNN2C=CN=C2)Br)O

InChI

InChI=1S/C10H10BrN3O.C7H5N/c11-9-5-8(1-2-10(9)15)6-13-14-4-3-12-7-14;8-6-7-4-2-1-3-5-7/h1-5,7,13,15H,6H2;1-5H