ethyl 3-[methylsulfonyl-[4-oxidanylidene-4-(4-pentoxyphenyl)butanoyl]amino]benzoate

Systemtic Name: ethyl 3-[methylsulfonyl-[4-oxidanylidene-4-(4-pentoxyphenyl)butanoyl]amino]benzoate Openeye Name: ethyl 3-[methylsulfonyl-[4-oxo-4-(4-pentoxyphenyl)butanoyl]amino]benzoate CAS Name: 3-[[1,4-dioxo-4-(4-pentoxyphenyl)butyl]-methylsulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[methylsulfonyl-[4-oxo-4-(4-pentoxyphenyl)butanoyl]amino]benzoate Traditional Name: 3-[[4-(4-amoxyphenyl)-4-keto-butanoyl]-mesyl-amino]benzoic acid ethyl ester Formula: C25H31NO7S MolecularWeight: 489.58114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)CCC(=O)N(C2=CC=CC(=C2)C(=O)OCC)S(=O)(=O)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)CCC(=O)N(C2=CC=CC(=C2)C(=O)OCC)S(=O)(=O)C

InChI

InChI=1S/C25H31NO7S/c1-4-6-7-17-33-22-13-11-19(12-14-22)23(27)15-16-24(28)26(34(3,30)31)21-10-8-9-20(18-21)25(29)32-5-2/h8-14,18H,4-7,15-17H2,1-3H3