2-[carboxy-[2-(1-phenylpyrazol-3-yl)ethyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[carboxy-[2-(1-phenylpyrazol-3-yl)ethyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[carboxy-[2-(1-phenylpyrazol-3-yl)ethyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[carboxy-[2-(1-phenyl-3-pyrazolyl)ethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[carboxy-[2-(1-phenylpyrazol-3-yl)ethyl]amino]-4-methylpentanoic acid Traditional Name: 2-[carboxy-[2-(1-phenylpyrazol-3-yl)ethyl]amino]-4-methyl-valeric acid Formula: C18H23N3O4 MolecularWeight: 345.39292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(CCC1=NN(C=C1)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)CC(C(=O)O)N(CCC1=NN(C=C1)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H23N3O4/c1-13(2)12-16(17(22)23)20(18(24)25)10-8-14-9-11-21(19-14)15-6-4-3-5-7-15/h3-7,9,11,13,16H,8,10,12H2,1-2H3,(H,22,23)(H,24,25)