2-azanyl-3-chloranyl-5-[1-(cyclopentylamino)-2-oxidanyl-ethyl]benzenecarbonitrile hydrochloride

Systemtic Name: 2-azanyl-3-chloranyl-5-[1-(cyclopentylamino)-2-oxidanyl-ethyl]benzenecarbonitrile hydrochloride Openeye Name: 2-amino-3-chloro-5-[1-(cyclopentylamino)-2-hydroxy-ethyl]benzonitrile hydrochloride CAS Name: 2-amino-3-chloro-5-[1-(cyclopentylamino)-2-hydroxyethyl]benzonitrile hydrochloride IUPAC Name: 2-amino-3-chloro-5-[1-(cyclopentylamino)-2-hydroxyethyl]benzonitrile hydrochloride Traditional Name: 2-amino-3-chloro-5-[1-(cyclopentylamino)-2-hydroxy-ethyl]benzonitrile hydrochloride Formula: C14H19Cl2N3O MolecularWeight: 316.22616

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(CO)C2=CC(=C(C(=C2)C#N)N)Cl.Cl

Isomeric SMILES

C1CCC(C1)NC(CO)C2=CC(=C(C(=C2)C#N)N)Cl.Cl

InChI

InChI=1S/C14H18ClN3O.ClH/c15-12-6-9(5-10(7-16)14(12)17)13(8-19)18-11-3-1-2-4-11;/h5-6,11,13,18-19H,1-4,8,17H2;1H