(3-bromanyl-4-methoxy-phenyl)methyl (3S)-1-cyclopentyl-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (3-bromanyl-4-methoxy-phenyl)methyl (3S)-1-cyclopentyl-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3-bromo-4-methoxy-phenyl)methyl (3S)-1-cyclopentyl-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-cyclopentyl-5-oxo-3-pyrrolidinecarboxylic acid (3-bromo-4-methoxyphenyl)methyl ester IUPAC Name: (3-bromo-4-methoxyphenyl)methyl (3S)-1-cyclopentyl-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-cyclopentyl-5-keto-pyrrolidine-3-carboxylic acid (3-bromo-4-methoxy-benzyl) ester Formula: C18H22BrNO4 MolecularWeight: 396.27558

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC(=O)C2CC(=O)N(C2)C3CCCC3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)COC(=O)[C@H]2CC(=O)N(C2)C3CCCC3)Br

InChI

InChI=1S/C18H22BrNO4/c1-23-16-7-6-12(8-15(16)19)11-24-18(22)13-9-17(21)20(10-13)14-4-2-3-5-14/h6-8,13-14H,2-5,9-11H2,1H3/t13-/m0/s1