2-azanyl-3,6-bis(chloranyl)-5-[1-oxidanyl-2-(propan-2-ylamino)ethyl]benzenecarbonitrile

Systemtic Name: 2-azanyl-3,6-bis(chloranyl)-5-[1-oxidanyl-2-(propan-2-ylamino)ethyl]benzenecarbonitrile Openeye Name: 2-amino-3,6-dichloro-5-[1-hydroxy-2-(isopropylamino)ethyl]benzonitrile CAS Name: 2-amino-3,6-dichloro-5-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzonitrile IUPAC Name: 2-amino-3,6-dichloro-5-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzonitrile Traditional Name: 2-amino-3,6-dichloro-5-[1-hydroxy-2-(isopropylamino)ethyl]benzonitrile Formula: C12H15Cl2N3O MolecularWeight: 288.173

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(C1=CC(=C(C(=C1Cl)C#N)N)Cl)O

Isomeric SMILES

CC(C)NCC(C1=CC(=C(C(=C1Cl)C#N)N)Cl)O

InChI

InChI=1S/C12H15Cl2N3O/c1-6(2)17-5-10(18)7-3-9(13)12(16)8(4-15)11(7)14/h3,6,10,17-18H,5,16H2,1-2H3