4-[[1-butan-2-yl-2,5-bis(oxidanylidene)pyrrolidin-3-yl]amino]-2-chloranyl-benzenecarbonitrile

Systemtic Name: 4-[[1-butan-2-yl-2,5-bis(oxidanylidene)pyrrolidin-3-yl]amino]-2-chloranyl-benzenecarbonitrile Openeye Name: 2-chloro-4-[(2,5-dioxo-1-sec-butyl-pyrrolidin-3-yl)amino]benzonitrile CAS Name: 4-[(1-butan-2-yl-2,5-dioxo-3-pyrrolidinyl)amino]-2-chlorobenzonitrile IUPAC Name: 4-[(1-butan-2-yl-2,5-dioxopyrrolidin-3-yl)amino]-2-chlorobenzonitrile Traditional Name: 2-chloro-4-[(2,5-diketo-1-sec-butyl-pyrrolidin-3-yl)amino]benzonitrile Formula: C15H16ClN3O2 MolecularWeight: 305.75944

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)CC(C1=O)NC2=CC(=C(C=C2)C#N)Cl

Isomeric SMILES

CCC(C)N1C(=O)CC(C1=O)NC2=CC(=C(C=C2)C#N)Cl

InChI

InChI=1S/C15H16ClN3O2/c1-3-9(2)19-14(20)7-13(15(19)21)18-11-5-4-10(8-17)12(16)6-11/h4-6,9,13,18H,3,7H2,1-2H3