4-azanyl-5-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-azanyl-5-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 4-amino-5-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]-5-oxo-pentanoic acid CAS Name: 4-amino-5-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-5-oxopentanoic acid IUPAC Name: 4-amino-5-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-5-oxopentanoic acid Traditional Name: 4-amino-5-keto-5-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]valeric acid Formula: C16H20N4O4 MolecularWeight: 332.3544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(CCC(=O)O)N

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(CCC(=O)O)N

InChI

InChI=1S/C16H20N4O4/c1-10-14(18-15(23)12(17)8-9-13(21)22)16(24)20(19(10)2)11-6-4-3-5-7-11/h3-7,12H,8-9,17H2,1-2H3,(H,18,23)(H,21,22)