hexanamide; 2-[2-oxidanyl-3-(propan-2-ylamino)propoxy]benzenecarbonitrile

Systemtic Name: hexanamide; 2-[2-oxidanyl-3-(propan-2-ylamino)propoxy]benzenecarbonitrile Openeye Name: hexanamide; 2-[2-hydroxy-3-(isopropylamino)propoxy]benzonitrile CAS Name: hexanamide; 2-[2-hydroxy-3-(propan-2-ylamino)propoxy]benzonitrile IUPAC Name: hexanamide; 2-[2-hydroxy-3-(propan-2-ylamino)propoxy]benzonitrile Traditional Name: hexanamide; 2-[2-hydroxy-3-(isopropylamino)propoxy]benzonitrile Formula: C19H31N3O3 MolecularWeight: 349.46774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N.CC(C)NCC(COC1=CC=CC=C1C#N)O

Isomeric SMILES

CCCCCC(=O)N.CC(C)NCC(COC1=CC=CC=C1C#N)O

InChI

InChI=1S/C13H18N2O2.C6H13NO/c1-10(2)15-8-12(16)9-17-13-6-4-3-5-11(13)7-14;1-2-3-4-5-6(7)8/h3-6,10,12,15-16H,8-9H2,1-2H3;2-5H2,1H3,(H2,7,8)