(8-hexyl-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) 2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoate

Systemtic Name: (8-hexyl-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) 2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoate Openeye Name: (8-hexyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) 3-phenyl-2-(p-tolylsulfonylamino)propanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoic acid (8-hexyl-4-oxo-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-7-yl) ester IUPAC Name: (8-hexyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) 2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoate Traditional Name: 3-phenyl-2-(tosylamino)propionic acid (8-hexyl-4-keto-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) ester Formula: C34H37NO6S MolecularWeight: 587.72568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C3=C(CCC3)C(=O)O2)OC(=O)C(CC4=CC=CC=C4)NS(=O)(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C3=C(CCC3)C(=O)O2)OC(=O)C(CC4=CC=CC=C4)NS(=O)(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C34H37NO6S/c1-3-4-5-9-13-25-21-29-27-14-10-15-28(27)33(36)41-32(29)22-31(25)40-34(37)30(20-24-11-7-6-8-12-24)35-42(38,39)26-18-16-23(2)17-19-26/h6-8,11-12,16-19,21-22,30,35H,3-5,9-10,13-15,20H2,1-2H3