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

Systemtic Name: 2-[[2-(3,3-dimethylbutan-2-ylamino)-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]-3-methoxy-benzenecarbonitrile Openeye Name: 2-[[3,4-dioxo-2-(1,2,2-trimethylpropylamino)cyclobuten-1-yl]amino]-3-methoxy-benzonitrile CAS Name: 2-[[2-(3,3-dimethylbutan-2-ylamino)-3,4-dioxo-1-cyclobutenyl]amino]-3-methoxybenzonitrile IUPAC Name: 2-[[2-(3,3-dimethylbutan-2-ylamino)-3,4-dioxocyclobuten-1-yl]amino]-3-methoxybenzonitrile Traditional Name: 2-[[3,4-diketo-2-(1,2,2-trimethylpropylamino)cyclobuten-1-yl]amino]-3-methoxy-benzonitrile Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C)C)NC1=C(C(=O)C1=O)NC2=C(C=CC=C2OC)C#N

Isomeric SMILES

CC(C(C)(C)C)NC1=C(C(=O)C1=O)NC2=C(C=CC=C2OC)C#N

InChI

InChI=1S/C18H21N3O3/c1-10(18(2,3)4)20-14-15(17(23)16(14)22)21-13-11(9-19)7-6-8-12(13)24-5/h6-8,10,20-21H,1-5H3