[4,7-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-5-yl] 2-[(4-methylphenyl)sulfonylamino]pentanoate

Systemtic Name: [4,7-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-5-yl] 2-[(4-methylphenyl)sulfonylamino]pentanoate Openeye Name: (3-benzyl-4,7-dimethyl-2-oxo-chromen-5-yl) 2-(p-tolylsulfonylamino)pentanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]pentanoic acid [4,7-dimethyl-2-oxo-3-(phenylmethyl)-1-benzopyran-5-yl] ester IUPAC Name: (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) 2-[(4-methylphenyl)sulfonylamino]pentanoate Traditional Name: 2-(tosylamino)valeric acid (3-benzyl-2-keto-4,7-dimethyl-chromen-5-yl) ester Formula: C30H31NO6S MolecularWeight: 533.63524

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OC1=CC(=CC2=C1C(=C(C(=O)O2)CC3=CC=CC=C3)C)C)NS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCC(C(=O)OC1=CC(=CC2=C1C(=C(C(=O)O2)CC3=CC=CC=C3)C)C)NS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C30H31NO6S/c1-5-9-25(31-38(34,35)23-14-12-19(2)13-15-23)30(33)37-27-17-20(3)16-26-28(27)21(4)24(29(32)36-26)18-22-10-7-6-8-11-22/h6-8,10-17,25,31H,5,9,18H2,1-4H3