(4-pyrrolidin-1-ylcarbonylphenyl)methyl 3-[(3-chlorophenyl)sulfonylamino]propanoate

Systemtic Name: (4-pyrrolidin-1-ylcarbonylphenyl)methyl 3-[(3-chlorophenyl)sulfonylamino]propanoate Openeye Name: [4-(pyrrolidine-1-carbonyl)phenyl]methyl 3-[(3-chlorophenyl)sulfonylamino]propanoate CAS Name: 3-[(3-chlorophenyl)sulfonylamino]propanoic acid [4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl ester IUPAC Name: [4-(pyrrolidine-1-carbonyl)phenyl]methyl 3-[(3-chlorophenyl)sulfonylamino]propanoate Traditional Name: 3-[(3-chlorophenyl)sulfonylamino]propionic acid [4-(pyrrolidine-1-carbonyl)benzyl] ester Formula: C21H23ClN2O5S MolecularWeight: 450.93572

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)COC(=O)CCNS(=O)(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)COC(=O)CCNS(=O)(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H23ClN2O5S/c22-18-4-3-5-19(14-18)30(27,28)23-11-10-20(25)29-15-16-6-8-17(9-7-16)21(26)24-12-1-2-13-24/h3-9,14,23H,1-2,10-13,15H2