(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 2-methyl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 2-methyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 2-methyl-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-methyl-5-(1-piperidinylsulfonyl)benzoic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 2-methyl-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-methyl-5-piperidinosulfonyl-benzoic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C27H25NO6S MolecularWeight: 491.5555

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)OCC3=CC(=O)OC4=C3C5=CC=CC=C5C=C4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)OCC3=CC(=O)OC4=C3C5=CC=CC=C5C=C4

InChI

InChI=1S/C27H25NO6S/c1-18-9-11-21(35(31,32)28-13-5-2-6-14-28)16-23(18)27(30)33-17-20-15-25(29)34-24-12-10-19-7-3-4-8-22(19)26(20)24/h3-4,7-12,15-16H,2,5-6,13-14,17H2,1H3