diethyl 2-[1,4-bis[(2,4,5-trimethylphenyl)sulfonylamino]naphthalen-2-yl]propanedioate

Systemtic Name: diethyl 2-[1,4-bis[(2,4,5-trimethylphenyl)sulfonylamino]naphthalen-2-yl]propanedioate Openeye Name: diethyl 2-[1,4-bis[(2,4,5-trimethylphenyl)sulfonylamino]-2-naphthyl]propanedioate CAS Name: 2-[1,4-bis[(2,4,5-trimethylphenyl)sulfonylamino]-2-naphthalenyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[1,4-bis[(2,4,5-trimethylphenyl)sulfonylamino]naphthalen-2-yl]propanedioate Traditional Name: 2-[1,4-bis[(2,4,5-trimethylphenyl)sulfonylamino]-2-naphthyl]malonic acid diethyl ester Formula: C35H40N2O8S2 MolecularWeight: 680.8307

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(C2=CC=CC=C2C(=C1)NS(=O)(=O)C3=C(C=C(C(=C3)C)C)C)NS(=O)(=O)C4=C(C=C(C(=C4)C)C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C1=C(C2=CC=CC=C2C(=C1)NS(=O)(=O)C3=C(C=C(C(=C3)C)C)C)NS(=O)(=O)C4=C(C=C(C(=C4)C)C)C)C(=O)OCC

InChI

InChI=1S/C35H40N2O8S2/c1-9-44-34(38)32(35(39)45-10-2)28-19-29(36-46(40,41)30-17-22(5)20(3)15-24(30)7)26-13-11-12-14-27(26)33(28)37-47(42,43)31-18-23(6)21(4)16-25(31)8/h11-19,32,36-37H,9-10H2,1-8H3