6-(butanoylamino)-3-(1-hydroxyethyl)-4-methyl-2-phenyl-benzoic acid

Systemtic Name: 6-(butanoylamino)-3-(1-hydroxyethyl)-4-methyl-2-phenyl-benzoic acid Openeye Name: 6-(butanoylamino)-3-(1-hydroxyethyl)-4-methyl-2-phenyl-benzoic acid CAS Name: 3-(1-hydroxyethyl)-4-methyl-6-(1-oxobutylamino)-2-phenylbenzoic acid IUPAC Name: 6-(butanoylamino)-3-(1-hydroxyethyl)-4-methyl-2-phenylbenzoic acid Traditional Name: 6-butyramido-3-(1-hydroxyethyl)-4-methyl-2-phenyl-benzoic acid Formula: C20H23NO4 MolecularWeight: 341.40092

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C(=C(C(=C1)C)C(C)O)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCC(=O)NC1=C(C(=C(C(=C1)C)C(C)O)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C20H23NO4/c1-4-8-16(23)21-15-11-12(2)17(13(3)22)18(19(15)20(24)25)14-9-6-5-7-10-14/h5-7,9-11,13,22H,4,8H2,1-3H3,(H,21,23)(H,24,25)