[3-(4-chloranylphenoxy)-4-oxidanylidene-chromen-7-yl] 4-piperidin-1-ylsulfonylbenzoate

Systemtic Name: [3-(4-chloranylphenoxy)-4-oxidanylidene-chromen-7-yl] 4-piperidin-1-ylsulfonylbenzoate Openeye Name: [3-(4-chlorophenoxy)-4-oxo-chromen-7-yl] 4-(1-piperidylsulfonyl)benzoate CAS Name: 4-(1-piperidinylsulfonyl)benzoic acid [3-(4-chlorophenoxy)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(4-chlorophenoxy)-4-oxochromen-7-yl] 4-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-piperidinosulfonylbenzoic acid [3-(4-chlorophenoxy)-4-keto-chromen-7-yl] ester Formula: C27H22ClNO7S MolecularWeight: 539.98408

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC3=CC4=C(C=C3)C(=O)C(=CO4)OC5=CC=C(C=C5)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC3=CC4=C(C=C3)C(=O)C(=CO4)OC5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H22ClNO7S/c28-19-6-8-20(9-7-19)35-25-17-34-24-16-21(10-13-23(24)26(25)30)36-27(31)18-4-11-22(12-5-18)37(32,33)29-14-2-1-3-15-29/h4-13,16-17H,1-3,14-15H2