methyl 4-[2,6-bis(oxidanylidene)cyclohexylidene]-4-[(4-bromophenyl)amino]butanoate

Systemtic Name: methyl 4-[2,6-bis(oxidanylidene)cyclohexylidene]-4-[(4-bromophenyl)amino]butanoate Openeye Name: methyl 4-(4-bromoanilino)-4-(2,6-dioxocyclohexylidene)butanoate CAS Name: 4-(4-bromoanilino)-4-(2,6-dioxocyclohexylidene)butanoic acid methyl ester IUPAC Name: methyl 4-(4-bromoanilino)-4-(2,6-dioxocyclohexylidene)butanoate Traditional Name: 4-(4-bromoanilino)-4-(2,6-diketocyclohexylidene)butyric acid methyl ester Formula: C17H18BrNO4 MolecularWeight: 380.23312

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=C1C(=O)CCCC1=O)NC2=CC=C(C=C2)Br

Isomeric SMILES

COC(=O)CCC(=C1C(=O)CCCC1=O)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C17H18BrNO4/c1-23-16(22)10-9-13(17-14(20)3-2-4-15(17)21)19-12-7-5-11(18)6-8-12/h5-8,19H,2-4,9-10H2,1H3