6,7-bis(bromanyl)-5-(4-methylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid

Systemtic Name: 6,7-bis(bromanyl)-5-(4-methylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Openeye Name: 6,7-dibromo-5-(4-methylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid CAS Name: 6,7-dibromo-5-[(4-methylphenyl)-oxomethyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid IUPAC Name: 6,7-dibromo-5-(4-methylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Traditional Name: 6,7-dibromo-5-p-toluoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Formula: C16H13Br2NO3 MolecularWeight: 427.08732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=C(C(=C3N2CCC3C(=O)O)Br)Br

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=C(C(=C3N2CCC3C(=O)O)Br)Br

InChI

InChI=1S/C16H13Br2NO3/c1-8-2-4-9(5-3-8)15(20)14-12(18)11(17)13-10(16(21)22)6-7-19(13)14/h2-5,10H,6-7H2,1H3,(H,21,22)