4-[[2-(butylamino)-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[2-(butylamino)-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]benzenecarbonitrile Openeye Name: 4-[[2-(butylamino)-3,4-dioxo-cyclobuten-1-yl]amino]benzonitrile CAS Name: 4-[[2-(butylamino)-3,4-dioxo-1-cyclobutenyl]amino]benzonitrile IUPAC Name: 4-[[2-(butylamino)-3,4-dioxocyclobuten-1-yl]amino]benzonitrile Traditional Name: 4-[[2-(butylamino)-3,4-diketo-cyclobuten-1-yl]amino]benzonitrile Formula: C15H15N3O2 MolecularWeight: 269.2985

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=O)C1=O)NC2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCNC1=C(C(=O)C1=O)NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C15H15N3O2/c1-2-3-8-17-12-13(15(20)14(12)19)18-11-6-4-10(9-16)5-7-11/h4-7,17-18H,2-3,8H2,1H3