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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)NC(CC(C)C)C(=O)O)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)NC(CC(C)C)C(=O)O)C

InChI

InChI=1S/C19H29N3O3/c1-13(2)12-16(18(23)24)20-19(25)22-10-8-21(9-11-22)17-7-5-6-14(3)15(17)4/h5-7,13,16H,8-12H2,1-4H3,(H,20,25)(H,23,24)