3-[4-[(2-phenylphenyl)carbamoylamino]piperidin-1-yl]sulfonylbenzoic acid

Systemtic Name: 3-[4-[(2-phenylphenyl)carbamoylamino]piperidin-1-yl]sulfonylbenzoic acid Openeye Name: 3-[[4-[(2-phenylphenyl)carbamoylamino]-1-piperidyl]sulfonyl]benzoic acid CAS Name: 3-[[4-[[oxo-(2-phenylanilino)methyl]amino]-1-piperidinyl]sulfonyl]benzoic acid IUPAC Name: 3-[4-[(2-phenylphenyl)carbamoylamino]piperidin-1-yl]sulfonylbenzoic acid Traditional Name: 3-[4-[(2-phenylphenyl)carbamoylamino]piperidino]sulfonylbenzoic acid Formula: C25H25N3O5S MolecularWeight: 479.5481

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)NC2=CC=CC=C2C3=CC=CC=C3)S(=O)(=O)C4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1CN(CCC1NC(=O)NC2=CC=CC=C2C3=CC=CC=C3)S(=O)(=O)C4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C25H25N3O5S/c29-24(30)19-9-6-10-21(17-19)34(32,33)28-15-13-20(14-16-28)26-25(31)27-23-12-5-4-11-22(23)18-7-2-1-3-8-18/h1-12,17,20H,13-16H2,(H,29,30)(H2,26,27,31)