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

Systemtic Name: 4-[[3,4-bis(oxidanylidene)-2-(1-phenylpropylamino)cyclobuten-1-yl]amino]benzenecarbonitrile Openeye Name: 4-[[3,4-dioxo-2-(1-phenylpropylamino)cyclobuten-1-yl]amino]benzonitrile CAS Name: 4-[[3,4-dioxo-2-(1-phenylpropylamino)-1-cyclobutenyl]amino]benzonitrile IUPAC Name: 4-[[3,4-dioxo-2-(1-phenylpropylamino)cyclobuten-1-yl]amino]benzonitrile Traditional Name: 4-[[3,4-diketo-2-(1-phenylpropylamino)cyclobuten-1-yl]amino]benzonitrile Formula: C20H17N3O2 MolecularWeight: 331.36788

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)NC2=C(C(=O)C2=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

CCC(C1=CC=CC=C1)NC2=C(C(=O)C2=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H17N3O2/c1-2-16(14-6-4-3-5-7-14)23-18-17(19(24)20(18)25)22-15-10-8-13(12-21)9-11-15/h3-11,16,22-23H,2H2,1H3