ethyl 4-[4-(3,4-dihydro-2H-chromen-4-ylcarbamoyl)piperidin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-(3,4-dihydro-2H-chromen-4-ylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[[4-(chroman-4-ylcarbamoyl)-1-piperidyl]sulfonyl]benzoate CAS Name: 4-[[4-[(3,4-dihydro-2H-1-benzopyran-4-ylamino)-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(3,4-dihydro-2H-chromen-4-ylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-(chroman-4-ylcarbamoyl)piperidino]sulfonylbenzoic acid ethyl ester Formula: C24H28N2O6S MolecularWeight: 472.55392

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3CCOC4=CC=CC=C34

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3CCOC4=CC=CC=C34

InChI

InChI=1S/C24H28N2O6S/c1-2-31-24(28)18-7-9-19(10-8-18)33(29,30)26-14-11-17(12-15-26)23(27)25-21-13-16-32-22-6-4-3-5-20(21)22/h3-10,17,21H,2,11-16H2,1H3,(H,25,27)