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

Systemtic Name: 2-methyl-3-[[2-(2-methylpropylamino)-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]benzenecarbonitrile Openeye Name: 3-[[2-(isobutylamino)-3,4-dioxo-cyclobuten-1-yl]amino]-2-methyl-benzonitrile CAS Name: 2-methyl-3-[[2-(2-methylpropylamino)-3,4-dioxo-1-cyclobutenyl]amino]benzonitrile IUPAC Name: 2-methyl-3-[[2-(2-methylpropylamino)-3,4-dioxocyclobuten-1-yl]amino]benzonitrile Traditional Name: 3-[[2-(isobutylamino)-3,4-diketo-cyclobuten-1-yl]amino]-2-methyl-benzonitrile Formula: C16H17N3O2 MolecularWeight: 283.32508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC2=C(C(=O)C2=O)NCC(C)C)C#N

Isomeric SMILES

CC1=C(C=CC=C1NC2=C(C(=O)C2=O)NCC(C)C)C#N

InChI

InChI=1S/C16H17N3O2/c1-9(2)8-18-13-14(16(21)15(13)20)19-12-6-4-5-11(7-17)10(12)3/h4-6,9,18-19H,8H2,1-3H3