[4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl] 2-[(4-methylphenyl)sulfonylamino]pentanoate

Systemtic Name: [4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl] 2-[(4-methylphenyl)sulfonylamino]pentanoate Openeye Name: (3-benzyl-4-methyl-2-oxo-chromen-7-yl) 2-(p-tolylsulfonylamino)pentanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]pentanoic acid [4-methyl-2-oxo-3-(phenylmethyl)-1-benzopyran-7-yl] ester IUPAC Name: (3-benzyl-4-methyl-2-oxochromen-7-yl) 2-[(4-methylphenyl)sulfonylamino]pentanoate Traditional Name: 2-(tosylamino)valeric acid (3-benzyl-2-keto-4-methyl-chromen-7-yl) ester Formula: C29H29NO6S MolecularWeight: 519.60866

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OC1=CC2=C(C=C1)C(=C(C(=O)O2)CC3=CC=CC=C3)C)NS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCC(C(=O)OC1=CC2=C(C=C1)C(=C(C(=O)O2)CC3=CC=CC=C3)C)NS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C29H29NO6S/c1-4-8-26(30-37(33,34)23-14-11-19(2)12-15-23)29(32)35-22-13-16-24-20(3)25(28(31)36-27(24)18-22)17-21-9-6-5-7-10-21/h5-7,9-16,18,26,30H,4,8,17H2,1-3H3