methyl 4-[1-(1,3-benzodioxol-5-yl)-2-oxidanylidene-2-[(4-phenylphenyl)sulfonylamino]ethoxy]-3-propyl-benzoate

Systemtic Name: methyl 4-[1-(1,3-benzodioxol-5-yl)-2-oxidanylidene-2-[(4-phenylphenyl)sulfonylamino]ethoxy]-3-propyl-benzoate Openeye Name: methyl 4-[1-(1,3-benzodioxol-5-yl)-2-oxo-2-[(4-phenylphenyl)sulfonylamino]ethoxy]-3-propyl-benzoate CAS Name: 4-[1-(1,3-benzodioxol-5-yl)-2-oxo-2-[(4-phenylphenyl)sulfonylamino]ethoxy]-3-propylbenzoic acid methyl ester IUPAC Name: methyl 4-[1-(1,3-benzodioxol-5-yl)-2-oxo-2-[(4-phenylphenyl)sulfonylamino]ethoxy]-3-propylbenzoate Traditional Name: 4-[1-(1,3-benzodioxol-5-yl)-2-keto-2-[(4-phenylphenyl)sulfonylamino]ethoxy]-3-propyl-benzoic acid methyl ester Formula: C32H29NO8S MolecularWeight: 587.63956

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)C(=O)OC)OC(C2=CC3=C(C=C2)OCO3)C(=O)NS(=O)(=O)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CCCC1=C(C=CC(=C1)C(=O)OC)OC(C2=CC3=C(C=C2)OCO3)C(=O)NS(=O)(=O)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H29NO8S/c1-3-7-23-18-25(32(35)38-2)13-16-27(23)41-30(24-12-17-28-29(19-24)40-20-39-28)31(34)33-42(36,37)26-14-10-22(11-15-26)21-8-5-4-6-9-21/h4-6,8-19,30H,3,7,20H2,1-2H3,(H,33,34)