1-cyclohexylpent-1-yn-3-yl 2-(phenylmethoxycarbonylamino)ethanoate

Systemtic Name: 1-cyclohexylpent-1-yn-3-yl 2-(phenylmethoxycarbonylamino)ethanoate Openeye Name: (3-cyclohexyl-1-ethyl-prop-2-ynyl) 2-(benzyloxycarbonylamino)acetate CAS Name: 2-(phenylmethoxycarbonylamino)acetic acid 1-cyclohexylpent-1-yn-3-yl ester IUPAC Name: 1-cyclohexylpent-1-yn-3-yl 2-(phenylmethoxycarbonylamino)acetate Traditional Name: 2-(benzyloxycarbonylamino)acetic acid (3-cyclohexyl-1-ethyl-prop-2-ynyl) ester Formula: C21H27NO4 MolecularWeight: 357.44338

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C#CC1CCCCC1)OC(=O)CNC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCC(C#CC1CCCCC1)OC(=O)CNC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H27NO4/c1-2-19(14-13-17-9-5-3-6-10-17)26-20(23)15-22-21(24)25-16-18-11-7-4-8-12-18/h4,7-8,11-12,17,19H,2-3,5-6,9-10,15-16H2,1H3,(H,22,24)