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

Systemtic Name: 2-[3-[3-[4-(2-hydroxyethyl)piperazin-1-yl]carbonylphenyl]phenyl]-4-methyl-pentanoic acid Openeye Name: 2-[3-[3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]phenyl]phenyl]-4-methyl-pentanoic acid CAS Name: 2-[3-[3-[[4-(2-hydroxyethyl)-1-piperazinyl]-oxomethyl]phenyl]phenyl]-4-methylpentanoic acid IUPAC Name: 2-[3-[3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]phenyl]phenyl]-4-methylpentanoic acid Traditional Name: 2-[3-[3-[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(=CC=C2)C(=O)N3CCN(CC3)CCO)C(=O)O

Isomeric SMILES

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

InChI

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