4-(4-bromophenyl)-2-(methoxycarbonylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(4-bromophenyl)-2-(methoxycarbonylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-bromophenyl)-2-(methoxycarbonylamino)-4-oxo-butanoic acid CAS Name: 4-(4-bromophenyl)-2-(methoxycarbonylamino)-4-oxobutanoic acid IUPAC Name: 4-(4-bromophenyl)-2-(methoxycarbonylamino)-4-oxobutanoic acid Traditional Name: 4-(4-bromophenyl)-2-(carbomethoxyamino)-4-keto-butyric acid Formula: C12H12BrNO5 MolecularWeight: 330.13138

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(CC(=O)C1=CC=C(C=C1)Br)C(=O)O

Isomeric SMILES

COC(=O)NC(CC(=O)C1=CC=C(C=C1)Br)C(=O)O

InChI

InChI=1S/C12H12BrNO5/c1-19-12(18)14-9(11(16)17)6-10(15)7-2-4-8(13)5-3-7/h2-5,9H,6H2,1H3,(H,14,18)(H,16,17)