(2S)-2-[(4-phenyl-1-pyridin-3-ylcarbonyl-piperidin-4-yl)carbonylamino]butanedioic acid

Systemtic Name: (2S)-2-[(4-phenyl-1-pyridin-3-ylcarbonyl-piperidin-4-yl)carbonylamino]butanedioic acid Openeye Name: (2S)-2-[[4-phenyl-1-(pyridine-3-carbonyl)piperidine-4-carbonyl]amino]butanedioic acid CAS Name: (2S)-2-[[oxo-[1-[oxo(3-pyridinyl)methyl]-4-phenyl-4-piperidinyl]methyl]amino]butanedioic acid IUPAC Name: (2S)-2-[[4-phenyl-1-(pyridine-3-carbonyl)piperidine-4-carbonyl]amino]butanedioic acid Traditional Name: (2S)-2-[(1-nicotinoyl-4-phenyl-isonipecotoyl)amino]succinic acid Formula: C22H23N3O6 MolecularWeight: 425.43452

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)C(=O)NC(CC(=O)O)C(=O)O)C(=O)C3=CN=CC=C3

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C22H23N3O6/c26-18(27)13-17(20(29)30)24-21(31)22(16-6-2-1-3-7-16)8-11-25(12-9-22)19(28)15-5-4-10-23-14-15/h1-7,10,14,17H,8-9,11-13H2,(H,24,31)(H,26,27)(H,29,30)/t17-/m0/s1