2-[4-chloranyl-3-[[(2S)-2-phenylpropyl]carbamoyl]phenyl]benzoic acid

Systemtic Name: 2-[4-chloranyl-3-[[(2S)-2-phenylpropyl]carbamoyl]phenyl]benzoic acid Openeye Name: 2-[4-chloro-3-[[(2S)-2-phenylpropyl]carbamoyl]phenyl]benzoic acid CAS Name: 2-[4-chloro-3-[oxo-[[(2S)-2-phenylpropyl]amino]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-chloro-3-[[(2S)-2-phenylpropyl]carbamoyl]phenyl]benzoic acid Traditional Name: 2-[4-chloro-3-[[(2S)-2-phenylpropyl]carbamoyl]phenyl]benzoic acid Formula: C23H20ClNO3 MolecularWeight: 393.8628

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=C(C=CC(=C1)C2=CC=CC=C2C(=O)O)Cl)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CNC(=O)C1=C(C=CC(=C1)C2=CC=CC=C2C(=O)O)Cl)C3=CC=CC=C3

InChI

InChI=1S/C23H20ClNO3/c1-15(16-7-3-2-4-8-16)14-25-22(26)20-13-17(11-12-21(20)24)18-9-5-6-10-19(18)23(27)28/h2-13,15H,14H2,1H3,(H,25,26)(H,27,28)/t15-/m1/s1