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

Systemtic Name: 4-[3-(2-azanylpyrrolidin-1-yl)-3-oxidanylidene-propyl]benzenecarbonitrile hydrochloride Openeye Name: 4-[3-(2-aminopyrrolidin-1-yl)-3-oxo-propyl]benzonitrile hydrochloride CAS Name: 4-[3-(2-amino-1-pyrrolidinyl)-3-oxopropyl]benzonitrile hydrochloride IUPAC Name: 4-[3-(2-aminopyrrolidin-1-yl)-3-oxopropyl]benzonitrile hydrochloride Traditional Name: 4-[3-(2-aminopyrrolidino)-3-keto-propyl]benzonitrile hydrochloride Formula: C14H18ClN3O MolecularWeight: 279.76522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O.ClH/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;1H