4-[[(3-phenyl-2,1-benzoxazol-5-yl)carbonylamino]methyl]cyclohexane-1-carboxylate

Systemtic Name: 4-[[(3-phenyl-2,1-benzoxazol-5-yl)carbonylamino]methyl]cyclohexane-1-carboxylate Openeye Name: 4-[[(3-phenyl-2,1-benzoxazole-5-carbonyl)amino]methyl]cyclohexanecarboxylate CAS Name: 4-[[[oxo-(3-phenyl-2,1-benzoxazol-5-yl)methyl]amino]methyl]-1-cyclohexanecarboxylate IUPAC Name: 4-[[(3-phenyl-2,1-benzoxazole-5-carbonyl)amino]methyl]cyclohexane-1-carboxylate Traditional Name: 4-[[(3-phenylanthranil-5-carbonyl)amino]methyl]cyclohexanecarboxylate Formula: C22H21N2O4- MolecularWeight: 377.41314

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CNC(=O)C2=CC3=C(ON=C3C=C2)C4=CC=CC=C4)C(=O)[O-]

Isomeric SMILES

C1CC(CCC1CNC(=O)C2=CC3=C(ON=C3C=C2)C4=CC=CC=C4)C(=O)[O-]

InChI

InChI=1S/C22H22N2O4/c25-21(23-13-14-6-8-16(9-7-14)22(26)27)17-10-11-19-18(12-17)20(28-24-19)15-4-2-1-3-5-15/h1-5,10-12,14,16H,6-9,13H2,(H,23,25)(H,26,27)/p-1