2-butyl-4-(3-chlorophenyl)-3,5-bis(oxidanylidene)-2-pyrrolidin-1-yl-heptanenitrile

Systemtic Name: 2-butyl-4-(3-chlorophenyl)-3,5-bis(oxidanylidene)-2-pyrrolidin-1-yl-heptanenitrile Openeye Name: 2-butyl-4-(3-chlorophenyl)-3,5-dioxo-2-pyrrolidin-1-yl-heptanenitrile CAS Name: 2-butyl-4-(3-chlorophenyl)-3,5-dioxo-2-(1-pyrrolidinyl)heptanenitrile IUPAC Name: 2-butyl-4-(3-chlorophenyl)-3,5-dioxo-2-pyrrolidin-1-ylheptanenitrile Traditional Name: 2-butyl-4-(3-chlorophenyl)-3,5-diketo-2-pyrrolidino-enanthonitrile Formula: C21H27ClN2O2 MolecularWeight: 374.90428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C#N)(C(=O)C(C1=CC(=CC=C1)Cl)C(=O)CC)N2CCCC2

Isomeric SMILES

CCCCC(C#N)(C(=O)C(C1=CC(=CC=C1)Cl)C(=O)CC)N2CCCC2

InChI

InChI=1S/C21H27ClN2O2/c1-3-5-11-21(15-23,24-12-6-7-13-24)20(26)19(18(25)4-2)16-9-8-10-17(22)14-16/h8-10,14,19H,3-7,11-13H2,1-2H3