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

Systemtic Name: 4-[[[2-(cyclopentylamino)-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]methyl]benzenecarbonitrile Openeye Name: 4-[[[2-(cyclopentylamino)-3,4-dioxo-cyclobuten-1-yl]amino]methyl]benzonitrile CAS Name: 4-[[[2-(cyclopentylamino)-3,4-dioxo-1-cyclobutenyl]amino]methyl]benzonitrile IUPAC Name: 4-[[[2-(cyclopentylamino)-3,4-dioxocyclobuten-1-yl]amino]methyl]benzonitrile Traditional Name: 4-[[[2-(cyclopentylamino)-3,4-diketo-cyclobuten-1-yl]amino]methyl]benzonitrile Formula: C17H17N3O2 MolecularWeight: 295.33578

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=C(C(=O)C2=O)NCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1CCC(C1)NC2=C(C(=O)C2=O)NCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H17N3O2/c18-9-11-5-7-12(8-6-11)10-19-14-15(17(22)16(14)21)20-13-3-1-2-4-13/h5-8,13,19-20H,1-4,10H2