methyl 6-[2-(4-bromophenyl)carbonylpyrazolidin-1-yl]-6-oxidanylidene-hexanoate

Systemtic Name: methyl 6-[2-(4-bromophenyl)carbonylpyrazolidin-1-yl]-6-oxidanylidene-hexanoate Openeye Name: methyl 6-[2-(4-bromobenzoyl)pyrazolidin-1-yl]-6-oxo-hexanoate CAS Name: 6-[2-[(4-bromophenyl)-oxomethyl]-1-pyrazolidinyl]-6-oxohexanoic acid methyl ester IUPAC Name: methyl 6-[2-(4-bromobenzoyl)pyrazolidin-1-yl]-6-oxohexanoate Traditional Name: 6-[2-(4-bromobenzoyl)pyrazolidin-1-yl]-6-keto-hexanoic acid methyl ester Formula: C17H21BrN2O4 MolecularWeight: 397.26364

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCC(=O)N1CCCN1C(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

COC(=O)CCCCC(=O)N1CCCN1C(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H21BrN2O4/c1-24-16(22)6-3-2-5-15(21)19-11-4-12-20(19)17(23)13-7-9-14(18)10-8-13/h7-10H,2-6,11-12H2,1H3