2-[2-azanyl-4-[5-(4-cyclohexyloxybut-1-ynyl)furan-2-yl]-2-ethyl-butoxy]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[2-azanyl-4-[5-(4-cyclohexyloxybut-1-ynyl)furan-2-yl]-2-ethyl-butoxy]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[2-amino-4-[5-[4-(cyclohexoxy)but-1-ynyl]-2-furyl]-2-ethyl-butoxy]-2-oxo-acetic acid CAS Name: 2-[2-amino-4-[5-(4-cyclohexyloxybut-1-ynyl)-2-furanyl]-2-ethylbutoxy]-2-oxoacetic acid IUPAC Name: 2-[2-amino-4-[5-(4-cyclohexyloxybut-1-ynyl)furan-2-yl]-2-ethylbutoxy]-2-oxoacetic acid Traditional Name: 2-[2-amino-4-[5-[4-(cyclohexoxy)but-1-ynyl]-2-furyl]-2-ethyl-butoxy]-2-keto-acetic acid Formula: C22H31NO6 MolecularWeight: 405.48464

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1=CC=C(O1)C#CCCOC2CCCCC2)(COC(=O)C(=O)O)N

Isomeric SMILES

CCC(CCC1=CC=C(O1)C#CCCOC2CCCCC2)(COC(=O)C(=O)O)N

InChI

InChI=1S/C22H31NO6/c1-2-22(23,16-28-21(26)20(24)25)14-13-19-12-11-18(29-19)10-6-7-15-27-17-8-4-3-5-9-17/h11-12,17H,2-5,7-9,13-16,23H2,1H3,(H,24,25)