N-[1-[4-ethoxy-3-(2-hydroxyphenyl)-2-propan-2-ylsulfonyl-phenyl]-3-oxidanylidene-propyl]methanamide

Systemtic Name: N-[1-[4-ethoxy-3-(2-hydroxyphenyl)-2-propan-2-ylsulfonyl-phenyl]-3-oxidanylidene-propyl]methanamide Openeye Name: N-[1-[4-ethoxy-3-(2-hydroxyphenyl)-2-isopropylsulfonyl-phenyl]-3-oxo-propyl]formamide CAS Name: N-[1-[4-ethoxy-3-(2-hydroxyphenyl)-2-propan-2-ylsulfonylphenyl]-3-oxopropyl]formamide IUPAC Name: N-[1-[4-ethoxy-3-(2-hydroxyphenyl)-2-propan-2-ylsulfonylphenyl]-3-oxopropyl]formamide Traditional Name: N-[1-[4-ethoxy-3-(2-hydroxyphenyl)-2-isopropylsulfonyl-phenyl]-3-keto-propyl]formamide Formula: C21H25NO6S MolecularWeight: 419.4913

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C(C=C1)C(CC=O)NC=O)S(=O)(=O)C(C)C)C2=CC=CC=C2O

Isomeric SMILES

CCOC1=C(C(=C(C=C1)C(CC=O)NC=O)S(=O)(=O)C(C)C)C2=CC=CC=C2O

InChI

InChI=1S/C21H25NO6S/c1-4-28-19-10-9-15(17(11-12-23)22-13-24)21(29(26,27)14(2)3)20(19)16-7-5-6-8-18(16)25/h5-10,12-14,17,25H,4,11H2,1-3H3,(H,22,24)