phenyl 2-(4-cyclohexylbutylcarbamoyl)-2-(1,3-oxazol-2-yl)hex-5-ynoate

Systemtic Name: phenyl 2-(4-cyclohexylbutylcarbamoyl)-2-(1,3-oxazol-2-yl)hex-5-ynoate Openeye Name: phenyl 2-(4-cyclohexylbutylcarbamoyl)-2-oxazol-2-yl-hex-5-ynoate CAS Name: 2-[(4-cyclohexylbutylamino)-oxomethyl]-2-(2-oxazolyl)-5-hexynoic acid phenyl ester IUPAC Name: phenyl 2-(4-cyclohexylbutylcarbamoyl)-2-(1,3-oxazol-2-yl)hex-5-ynoate Traditional Name: 2-(4-cyclohexylbutylcarbamoyl)-2-oxazol-2-yl-hex-5-ynoic acid phenyl ester Formula: C26H32N2O4 MolecularWeight: 436.54328

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCC(C1=NC=CO1)(C(=O)NCCCCC2CCCCC2)C(=O)OC3=CC=CC=C3

Isomeric SMILES

C#CCCC(C1=NC=CO1)(C(=O)NCCCCC2CCCCC2)C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C26H32N2O4/c1-2-3-17-26(24-28-19-20-31-24,25(30)32-22-15-8-5-9-16-22)23(29)27-18-11-10-14-21-12-6-4-7-13-21/h1,5,8-9,15-16,19-21H,3-4,6-7,10-14,17-18H2,(H,27,29)