4-[3-(2-azanylpyrrolidin-1-yl)-3-oxidanylidene-propyl]benzenecarbonitrile

Systemtic Name: 4-[3-(2-azanylpyrrolidin-1-yl)-3-oxidanylidene-propyl]benzenecarbonitrile Openeye Name: 4-[3-(2-aminopyrrolidin-1-yl)-3-oxo-propyl]benzonitrile CAS Name: 4-[3-(2-amino-1-pyrrolidinyl)-3-oxopropyl]benzonitrile IUPAC Name: 4-[3-(2-aminopyrrolidin-1-yl)-3-oxopropyl]benzonitrile Traditional Name: 4-[3-(2-aminopyrrolidino)-3-keto-propyl]benzonitrile Formula: C14H17N3O MolecularWeight: 243.30428

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCC2=CC=C(C=C2)C#N)N

Isomeric SMILES

C1CC(N(C1)C(=O)CCC2=CC=C(C=C2)C#N)N

InChI

InChI=1S/C14H17N3O/c15-10-12-5-3-11(4-6-12)7-8-14(18)17-9-1-2-13(17)16/h3-6,13H,1-2,7-9,16H2