3-[(3-azanyl-2-oxidanyl-propyl)-phenyl-amino]propanenitrile

Systemtic Name: 3-[(3-azanyl-2-oxidanyl-propyl)-phenyl-amino]propanenitrile Openeye Name: 3-(N-(3-amino-2-hydroxy-propyl)anilino)propanenitrile CAS Name: 3-(N-(3-amino-2-hydroxypropyl)anilino)propanenitrile IUPAC Name: 3-(N-(3-amino-2-hydroxypropyl)anilino)propanenitrile Traditional Name: 3-(N-(3-amino-2-hydroxy-propyl)anilino)propionitrile Formula: C12H17N3O MolecularWeight: 219.28288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCC#N)CC(CN)O

Isomeric SMILES

C1=CC=C(C=C1)N(CCC#N)CC(CN)O

InChI

InChI=1S/C12H17N3O/c13-7-4-8-15(10-12(16)9-14)11-5-2-1-3-6-11/h1-3,5-6,12,16H,4,8-10,14H2