methyl 2-[3-(4-bromophenyl)-2-oxidanylidene-1,4-benzoxazin-6-yl]propanoate

Systemtic Name: methyl 2-[3-(4-bromophenyl)-2-oxidanylidene-1,4-benzoxazin-6-yl]propanoate Openeye Name: methyl 2-[3-(4-bromophenyl)-2-oxo-1,4-benzoxazin-6-yl]propanoate CAS Name: 2-[3-(4-bromophenyl)-2-oxo-1,4-benzoxazin-6-yl]propanoic acid methyl ester IUPAC Name: methyl 2-[3-(4-bromophenyl)-2-oxo-1,4-benzoxazin-6-yl]propanoate Traditional Name: 2-[3-(4-bromophenyl)-2-keto-1,4-benzoxazin-6-yl]propionic acid methyl ester Formula: C18H14BrNO4 MolecularWeight: 388.21206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OC(=O)C(=N2)C3=CC=C(C=C3)Br)C(=O)OC

Isomeric SMILES

CC(C1=CC2=C(C=C1)OC(=O)C(=N2)C3=CC=C(C=C3)Br)C(=O)OC

InChI

InChI=1S/C18H14BrNO4/c1-10(17(21)23-2)12-5-8-15-14(9-12)20-16(18(22)24-15)11-3-6-13(19)7-4-11/h3-10H,1-2H3