4-[(1-pyrrolidin-2-ylcarbonylpyrrolidin-3-yl)amino]benzene-1,2-dicarbonitrile hydrochloride

Systemtic Name: 4-[(1-pyrrolidin-2-ylcarbonylpyrrolidin-3-yl)amino]benzene-1,2-dicarbonitrile hydrochloride Openeye Name: 4-[[1-(pyrrolidine-2-carbonyl)pyrrolidin-3-yl]amino]phthalonitrile hydrochloride CAS Name: 4-[[1-[oxo(2-pyrrolidinyl)methyl]-3-pyrrolidinyl]amino]benzene-1,2-dicarbonitrile hydrochloride IUPAC Name: 4-[[1-(pyrrolidine-2-carbonyl)pyrrolidin-3-yl]amino]benzene-1,2-dicarbonitrile hydrochloride Traditional Name: 4-[(1-prolylpyrrolidin-3-yl)amino]phthalonitrile hydrochloride Formula: C17H20ClN5O MolecularWeight: 345.8266

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)N2CCC(C2)NC3=CC(=C(C=C3)C#N)C#N.Cl

Isomeric SMILES

C1CC(NC1)C(=O)N2CCC(C2)NC3=CC(=C(C=C3)C#N)C#N.Cl

InChI

InChI=1S/C17H19N5O.ClH/c18-9-12-3-4-14(8-13(12)10-19)21-15-5-7-22(11-15)17(23)16-2-1-6-20-16;/h3-4,8,15-16,20-21H,1-2,5-7,11H2;1H