4-[[(3R,4R)-3-azanyl-4-pyrrolidin-1-ylcarbonyl-pyrrolidin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[(3R,4R)-3-azanyl-4-pyrrolidin-1-ylcarbonyl-pyrrolidin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[(3R,4R)-3-amino-4-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]methyl]benzonitrile CAS Name: 4-[[(3R,4R)-3-amino-4-[oxo(1-pyrrolidinyl)methyl]-1-pyrrolidinyl]methyl]benzonitrile IUPAC Name: 4-[[(3R,4R)-3-amino-4-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]methyl]benzonitrile Traditional Name: 4-[[(3R,4R)-3-amino-4-(pyrrolidine-1-carbonyl)pyrrolidino]methyl]benzonitrile Formula: C17H22N4O MolecularWeight: 298.38278

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CN(CC2N)CC3=CC=C(C=C3)C#N

Isomeric SMILES

C1CCN(C1)C(=O)[C@@H]2CN(C[C@@H]2N)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H22N4O/c18-9-13-3-5-14(6-4-13)10-20-11-15(16(19)12-20)17(22)21-7-1-2-8-21/h3-6,15-16H,1-2,7-8,10-12,19H2/t15-,16+/m1/s1