methyl 5-[(3-bromophenyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[(3-bromophenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: methyl 5-(3-bromoanilino)-5-oxo-pentanoate CAS Name: 5-(3-bromoanilino)-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-(3-bromoanilino)-5-oxopentanoate Traditional Name: 5-(3-bromoanilino)-5-keto-valeric acid methyl ester Formula: C12H14BrNO3 MolecularWeight: 300.14846

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)NC1=CC(=CC=C1)Br

Isomeric SMILES

COC(=O)CCCC(=O)NC1=CC(=CC=C1)Br

InChI

InChI=1S/C12H14BrNO3/c1-17-12(16)7-3-6-11(15)14-10-5-2-4-9(13)8-10/h2,4-5,8H,3,6-7H2,1H3,(H,14,15)