(8-methoxy-4-methyl-6-oxidanylidene-benzo[c]chromen-3-yl) 2-[(4-methylphenyl)sulfonylamino]pentanoate

Systemtic Name: (8-methoxy-4-methyl-6-oxidanylidene-benzo[c]chromen-3-yl) 2-[(4-methylphenyl)sulfonylamino]pentanoate Openeye Name: (8-methoxy-4-methyl-6-oxo-benzo[c]chromen-3-yl) 2-(p-tolylsulfonylamino)pentanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]pentanoic acid (8-methoxy-4-methyl-6-oxo-3-benzo[c][1]benzopyranyl) ester IUPAC Name: (8-methoxy-4-methyl-6-oxobenzo[c]chromen-3-yl) 2-[(4-methylphenyl)sulfonylamino]pentanoate Traditional Name: 2-(tosylamino)valeric acid (6-keto-8-methoxy-4-methyl-benzo[c]chromen-3-yl) ester Formula: C27H27NO7S MolecularWeight: 509.57078

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OC1=C(C2=C(C=C1)C3=C(C=C(C=C3)OC)C(=O)O2)C)NS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCC(C(=O)OC1=C(C2=C(C=C1)C3=C(C=C(C=C3)OC)C(=O)O2)C)NS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H27NO7S/c1-5-6-23(28-36(31,32)19-10-7-16(2)8-11-19)27(30)34-24-14-13-21-20-12-9-18(33-4)15-22(20)26(29)35-25(21)17(24)3/h7-15,23,28H,5-6H2,1-4H3