2-azanyl-3-bromanyl-5-[1-(cyclohexylamino)-2-oxidanyl-ethyl]benzenecarbonitrile hydrochloride

Systemtic Name: 2-azanyl-3-bromanyl-5-[1-(cyclohexylamino)-2-oxidanyl-ethyl]benzenecarbonitrile hydrochloride Openeye Name: 2-amino-3-bromo-5-[1-(cyclohexylamino)-2-hydroxy-ethyl]benzonitrile hydrochloride CAS Name: 2-amino-3-bromo-5-[1-(cyclohexylamino)-2-hydroxyethyl]benzonitrile hydrochloride IUPAC Name: 2-amino-3-bromo-5-[1-(cyclohexylamino)-2-hydroxyethyl]benzonitrile hydrochloride Traditional Name: 2-amino-3-bromo-5-[1-(cyclohexylamino)-2-hydroxy-ethyl]benzonitrile hydrochloride Formula: C15H21BrClN3O MolecularWeight: 374.70374

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(CO)C2=CC(=C(C(=C2)C#N)N)Br.Cl

Isomeric SMILES

C1CCC(CC1)NC(CO)C2=CC(=C(C(=C2)C#N)N)Br.Cl

InChI

InChI=1S/C15H20BrN3O.ClH/c16-13-7-10(6-11(8-17)15(13)18)14(9-20)19-12-4-2-1-3-5-12;/h6-7,12,14,19-20H,1-5,9,18H2;1H