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

Systemtic Name: (7-methyl-2-oxidanylidene-chromen-4-yl)methyl 1-(phenylsulfonyl)piperidine-2-carboxylate Openeye Name: (7-methyl-2-oxo-chromen-4-yl)methyl 1-(benzenesulfonyl)piperidine-2-carboxylate CAS Name: 1-(benzenesulfonyl)-2-piperidinecarboxylic acid (7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxochromen-4-yl)methyl 1-(benzenesulfonyl)piperidine-2-carboxylate Traditional Name: 1-besylpipecolinic acid (2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C23H23NO6S MolecularWeight: 441.49682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3CCCCN3S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3CCCCN3S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H23NO6S/c1-16-10-11-19-17(14-22(25)30-21(19)13-16)15-29-23(26)20-9-5-6-12-24(20)31(27,28)18-7-3-2-4-8-18/h2-4,7-8,10-11,13-14,20H,5-6,9,12,15H2,1H3