ethyl 4-[2-(7-bromanyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(7-bromanyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(7-bromo-3-oxo-1,4-benzoxazin-4-yl)acetyl]piperazine-1-carboxylate CAS Name: 4-[2-(7-bromo-3-oxo-1,4-benzoxazin-4-yl)-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(7-bromo-3-oxo-1,4-benzoxazin-4-yl)acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(7-bromo-3-keto-1,4-benzoxazin-4-yl)acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H20BrN3O5 MolecularWeight: 426.2618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CN2C(=O)COC3=C2C=CC(=C3)Br

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CN2C(=O)COC3=C2C=CC(=C3)Br

InChI

InChI=1S/C17H20BrN3O5/c1-2-25-17(24)20-7-5-19(6-8-20)15(22)10-21-13-4-3-12(18)9-14(13)26-11-16(21)23/h3-4,9H,2,5-8,10-11H2,1H3