methyl 3-[(2S)-2-pyrrolidin-1-ylcarbonylpyrrolidin-1-yl]carbonylbenzoate

Systemtic Name: methyl 3-[(2S)-2-pyrrolidin-1-ylcarbonylpyrrolidin-1-yl]carbonylbenzoate Openeye Name: methyl 3-[(2S)-2-(pyrrolidine-1-carbonyl)pyrrolidine-1-carbonyl]benzoate CAS Name: 3-[oxo-[(2S)-2-[oxo(1-pyrrolidinyl)methyl]-1-pyrrolidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(2S)-2-(pyrrolidine-1-carbonyl)pyrrolidine-1-carbonyl]benzoate Traditional Name: 3-[(2S)-2-(pyrrolidine-1-carbonyl)pyrrolidine-1-carbonyl]benzoic acid methyl ester Formula: C18H22N2O4 MolecularWeight: 330.37828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C(=O)N2CCCC2C(=O)N3CCCC3

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C(=O)N2CCC[C@H]2C(=O)N3CCCC3

InChI

InChI=1S/C18H22N2O4/c1-24-18(23)14-7-4-6-13(12-14)16(21)20-11-5-8-15(20)17(22)19-9-2-3-10-19/h4,6-7,12,15H,2-3,5,8-11H2,1H3/t15-/m0/s1