2-[[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonylamino]-3-methyl-pentanoic acid

Systemtic Name: 2-[[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonylamino]-3-methyl-pentanoic acid Openeye Name: 2-[[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]amino]-3-methyl-pentanoic acid CAS Name: 2-[[[4-(2,3-dimethylphenyl)-1-piperazinyl]-oxomethyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]amino]-3-methylpentanoic acid Traditional Name: 2-[[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]amino]-3-methyl-valeric acid Formula: C19H29N3O3 MolecularWeight: 347.45186

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)N1CCN(CC1)C2=CC=CC(=C2C)C

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)N1CCN(CC1)C2=CC=CC(=C2C)C

InChI

InChI=1S/C19H29N3O3/c1-5-13(2)17(18(23)24)20-19(25)22-11-9-21(10-12-22)16-8-6-7-14(3)15(16)4/h6-8,13,17H,5,9-12H2,1-4H3,(H,20,25)(H,23,24)