4-[(3-bromophenyl)amino]-6-[[2-ethoxy-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]quinoline-3-carbonitrile

Systemtic Name: 4-[(3-bromophenyl)amino]-6-[[2-ethoxy-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]quinoline-3-carbonitrile Openeye Name: 4-(3-bromoanilino)-6-[(2-ethoxy-3,4-dioxo-cyclobuten-1-yl)amino]quinoline-3-carbonitrile CAS Name: 4-(3-bromoanilino)-6-[(2-ethoxy-3,4-dioxo-1-cyclobutenyl)amino]-3-quinolinecarbonitrile IUPAC Name: 4-(3-bromoanilino)-6-[(2-ethoxy-3,4-dioxocyclobuten-1-yl)amino]quinoline-3-carbonitrile Traditional Name: 4-(3-bromoanilino)-6-[(2-ethoxy-3,4-diketo-cyclobuten-1-yl)amino]quinoline-3-carbonitrile Formula: C22H15BrN4O3 MolecularWeight: 463.2835

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=O)C1=O)NC2=CC3=C(C(=CN=C3C=C2)C#N)NC4=CC(=CC=C4)Br

Isomeric SMILES

CCOC1=C(C(=O)C1=O)NC2=CC3=C(C(=CN=C3C=C2)C#N)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C22H15BrN4O3/c1-2-30-22-19(20(28)21(22)29)27-15-6-7-17-16(9-15)18(12(10-24)11-25-17)26-14-5-3-4-13(23)8-14/h3-9,11,27H,2H2,1H3,(H,25,26)