3-[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonyl-2,2-dimethyl-cyclopropane-1-carboxylic acid

Systemtic Name: 3-[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonyl-2,2-dimethyl-cyclopropane-1-carboxylic acid Openeye Name: 3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2,2-dimethyl-cyclopropanecarboxylic acid CAS Name: 3-[[4-(2,5-dimethylphenyl)-1-piperazinyl]-oxomethyl]-2,2-dimethyl-1-cyclopropanecarboxylic acid IUPAC Name: 3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2,2-dimethylcyclopropane-1-carboxylic acid Traditional Name: 3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2,2-dimethyl-cyclopropanecarboxylic acid Formula: C19H26N2O3 MolecularWeight: 330.42134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3C(C3(C)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3C(C3(C)C)C(=O)O

InChI

InChI=1S/C19H26N2O3/c1-12-5-6-13(2)14(11-12)20-7-9-21(10-8-20)17(22)15-16(18(23)24)19(15,3)4/h5-6,11,15-16H,7-10H2,1-4H3,(H,23,24)