(2-oxidanylidenechromen-7-yl) 3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoate

Systemtic Name: (2-oxidanylidenechromen-7-yl) 3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoate Openeye Name: (2-oxochromen-7-yl) 3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoate CAS Name: 3-[4-(1-pyrrolidinylsulfonyl)phenyl]propanoic acid (2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (2-oxochromen-7-yl) 3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoate Traditional Name: 3-(4-pyrrolidinosulfonylphenyl)propionic acid (2-ketochromen-7-yl) ester Formula: C22H21NO6S MolecularWeight: 427.47024

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)OC3=CC4=C(C=C3)C=CC(=O)O4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)OC3=CC4=C(C=C3)C=CC(=O)O4

InChI

InChI=1S/C22H21NO6S/c24-21(28-18-8-6-17-7-12-22(25)29-20(17)15-18)11-5-16-3-9-19(10-4-16)30(26,27)23-13-1-2-14-23/h3-4,6-10,12,15H,1-2,5,11,13-14H2