(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 1-(phenylsulfonyl)piperidine-2-carboxylate

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 1-(phenylsulfonyl)piperidine-2-carboxylate Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl 1-(benzenesulfonyl)piperidine-2-carboxylate CAS Name: 1-(benzenesulfonyl)-2-piperidinecarboxylic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl 1-(benzenesulfonyl)piperidine-2-carboxylate Traditional Name: 1-besylpipecolinic acid (7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C24H25NO6S MolecularWeight: 455.5234

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3CCCCN3S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3CCCCN3S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H25NO6S/c1-2-17-11-12-20-18(15-23(26)31-22(20)14-17)16-30-24(27)21-10-6-7-13-25(21)32(28,29)19-8-4-3-5-9-19/h3-5,8-9,11-12,14-15,21H,2,6-7,10,13,16H2,1H3