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

Systemtic Name: 2-[2-azanyl-4-[5-(5-cyclohexylpent-1-ynyl)furan-2-yl]-2-methyl-butoxy]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[2-amino-4-[5-(5-cyclohexylpent-1-ynyl)-2-furyl]-2-methyl-butoxy]-2-oxo-acetic acid CAS Name: 2-[2-amino-4-[5-(5-cyclohexylpent-1-ynyl)-2-furanyl]-2-methylbutoxy]-2-oxoacetic acid IUPAC Name: 2-[2-amino-4-[5-(5-cyclohexylpent-1-ynyl)furan-2-yl]-2-methylbutoxy]-2-oxoacetic acid Traditional Name: 2-[2-amino-4-[5-(5-cyclohexylpent-1-ynyl)-2-furyl]-2-methyl-butoxy]-2-keto-acetic acid Formula: C22H31NO5 MolecularWeight: 389.48524

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(O1)C#CCCCC2CCCCC2)(COC(=O)C(=O)O)N

Isomeric SMILES

CC(CCC1=CC=C(O1)C#CCCCC2CCCCC2)(COC(=O)C(=O)O)N

InChI

InChI=1S/C22H31NO5/c1-22(23,16-27-21(26)20(24)25)15-14-19-13-12-18(28-19)11-7-3-6-10-17-8-4-2-5-9-17/h12-13,17H,2-6,8-10,14-16,23H2,1H3,(H,24,25)