2-[3-[4-[4-(2-hydroxyethyl)piperazin-1-yl]carbonylphenyl]phenyl]-4-methyl-pentanoic acid

Systemtic Name: 2-[3-[4-[4-(2-hydroxyethyl)piperazin-1-yl]carbonylphenyl]phenyl]-4-methyl-pentanoic acid Openeye Name: 2-[3-[4-[4-(2-hydroxyethyl)piperazine-1-carbonyl]phenyl]phenyl]-4-methyl-pentanoic acid CAS Name: 2-[3-[4-[[4-(2-hydroxyethyl)-1-piperazinyl]-oxomethyl]phenyl]phenyl]-4-methylpentanoic acid IUPAC Name: 2-[3-[4-[4-(2-hydroxyethyl)piperazine-1-carbonyl]phenyl]phenyl]-4-methylpentanoic acid Traditional Name: 2-[3-[4-[4-(2-hydroxyethyl)piperazine-1-carbonyl]phenyl]phenyl]-4-methyl-valeric acid Formula: C25H32N2O4 MolecularWeight: 424.53258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC(=C1)C2=CC=C(C=C2)C(=O)N3CCN(CC3)CCO)C(=O)O

Isomeric SMILES

CC(C)CC(C1=CC=CC(=C1)C2=CC=C(C=C2)C(=O)N3CCN(CC3)CCO)C(=O)O

InChI

InChI=1S/C25H32N2O4/c1-18(2)16-23(25(30)31)22-5-3-4-21(17-22)19-6-8-20(9-7-19)24(29)27-12-10-26(11-13-27)14-15-28/h3-9,17-18,23,28H,10-16H2,1-2H3,(H,30,31)