ethyl N-[1-(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)propylamino]carbamate

Systemtic Name: ethyl N-[1-(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)propylamino]carbamate Openeye Name: ethyl N-[1-(3-bromo-6-oxo-cyclohexa-2,4-dien-1-ylidene)propylamino]carbamate CAS Name: N-[1-(3-bromo-6-oxo-1-cyclohexa-2,4-dienylidene)propylamino]carbamic acid ethyl ester IUPAC Name: ethyl N-[1-(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)propylamino]carbamate Traditional Name: N-[1-(3-bromo-6-keto-cyclohexa-2,4-dien-1-ylidene)propylamino]carbamic acid ethyl ester Formula: C12H15BrN2O3 MolecularWeight: 315.1631

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C=C(C=CC1=O)Br)NNC(=O)OCC

Isomeric SMILES

CCC(=C1C=C(C=CC1=O)Br)NNC(=O)OCC

InChI

InChI=1S/C12H15BrN2O3/c1-3-10(14-15-12(17)18-4-2)9-7-8(13)5-6-11(9)16/h5-7,14H,3-4H2,1-2H3,(H,15,17)