2-azanyl-5-(4-fluorophenyl)-2-methyl-5-(4-thiophen-3-ylcarbonylphenoxy)pentanoic acid

Systemtic Name: 2-azanyl-5-(4-fluorophenyl)-2-methyl-5-(4-thiophen-3-ylcarbonylphenoxy)pentanoic acid Openeye Name: 2-amino-5-(4-fluorophenyl)-2-methyl-5-[4-(thiophene-3-carbonyl)phenoxy]pentanoic acid CAS Name: 2-amino-5-(4-fluorophenyl)-2-methyl-5-[4-[oxo(3-thiophenyl)methyl]phenoxy]pentanoic acid IUPAC Name: 2-amino-5-(4-fluorophenyl)-2-methyl-5-[4-(thiophene-3-carbonyl)phenoxy]pentanoic acid Traditional Name: 2-amino-5-(4-fluorophenyl)-2-methyl-5-[4-(3-thenoyl)phenoxy]valeric acid Formula: C23H22FNO4S MolecularWeight: 427.488483

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(C1=CC=C(C=C1)F)OC2=CC=C(C=C2)C(=O)C3=CSC=C3)(C(=O)O)N

Isomeric SMILES

CC(CCC(C1=CC=C(C=C1)F)OC2=CC=C(C=C2)C(=O)C3=CSC=C3)(C(=O)O)N

InChI

InChI=1S/C23H22FNO4S/c1-23(25,22(27)28)12-10-20(15-2-6-18(24)7-3-15)29-19-8-4-16(5-9-19)21(26)17-11-13-30-14-17/h2-9,11,13-14,20H,10,12,25H2,1H3,(H,27,28)