1-acetamido-N-[(2S)-1-(1,3-benzoxazol-2-yl)-1-oxidanylidene-pentan-2-yl]cyclohexane-1-carboxamide

Systemtic Name: 1-acetamido-N-[(2S)-1-(1,3-benzoxazol-2-yl)-1-oxidanylidene-pentan-2-yl]cyclohexane-1-carboxamide Openeye Name: 1-acetamido-N-[(1S)-1-(1,3-benzoxazole-2-carbonyl)butyl]cyclohexanecarboxamide CAS Name: 1-acetamido-N-[(2S)-1-(1,3-benzoxazol-2-yl)-1-oxopentan-2-yl]-1-cyclohexanecarboxamide IUPAC Name: 1-acetamido-N-[(2S)-1-(1,3-benzoxazol-2-yl)-1-oxopentan-2-yl]cyclohexane-1-carboxamide Traditional Name: 1-acetamido-N-[(1S)-1-(1,3-benzoxazole-2-carbonyl)butyl]cyclohexanecarboxamide Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)C1=NC2=CC=CC=C2O1)NC(=O)C3(CCCCC3)NC(=O)C

Isomeric SMILES

CCC[C@@H](C(=O)C1=NC2=CC=CC=C2O1)NC(=O)C3(CCCCC3)NC(=O)C

InChI

InChI=1S/C21H27N3O4/c1-3-9-16(18(26)19-22-15-10-5-6-11-17(15)28-19)23-20(27)21(24-14(2)25)12-7-4-8-13-21/h5-6,10-11,16H,3-4,7-9,12-13H2,1-2H3,(H,23,27)(H,24,25)/t16-/m0/s1