methyl 2-[4-[(3-pyrrolidin-1-ylcarbonylphenyl)carbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-[(3-pyrrolidin-1-ylcarbonylphenyl)carbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[oxo-[3-[oxo(1-pyrrolidinyl)methyl]anilino]methyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-[[3-(pyrrolidine-1-carbonyl)phenyl]carbamoyl]piperidino]sulfonylbenzoic acid methyl ester Formula: C25H29N3O6S MolecularWeight: 499.57926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)C(=O)N4CCCC4

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)C(=O)N4CCCC4

InChI

InChI=1S/C25H29N3O6S/c1-34-25(31)21-9-2-3-10-22(21)35(32,33)28-15-11-18(12-16-28)23(29)26-20-8-6-7-19(17-20)24(30)27-13-4-5-14-27/h2-3,6-10,17-18H,4-5,11-16H2,1H3,(H,26,29)