[3-azanyl-5-[5-(5-cyclohexylpent-1-ynyl)thiophen-2-yl]-3-ethyl-pentyl]phosphonic acid

Systemtic Name: [3-azanyl-5-[5-(5-cyclohexylpent-1-ynyl)thiophen-2-yl]-3-ethyl-pentyl]phosphonic acid Openeye Name: [3-amino-5-[5-(5-cyclohexylpent-1-ynyl)-2-thienyl]-3-ethyl-pentyl]phosphonic acid CAS Name: [3-amino-5-[5-(5-cyclohexylpent-1-ynyl)-2-thiophenyl]-3-ethylpentyl]phosphonic acid IUPAC Name: [3-amino-5-[5-(5-cyclohexylpent-1-ynyl)thiophen-2-yl]-3-ethylpentyl]phosphonic acid Traditional Name: [3-amino-5-[5-(5-cyclohexylpent-1-ynyl)-2-thienyl]-3-ethyl-pentyl]phosphonic acid Formula: C22H36NO3PS MolecularWeight: 425.564901

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1=CC=C(S1)C#CCCCC2CCCCC2)(CCP(=O)(O)O)N

Isomeric SMILES

CCC(CCC1=CC=C(S1)C#CCCCC2CCCCC2)(CCP(=O)(O)O)N

InChI

InChI=1S/C22H36NO3PS/c1-2-22(23,17-18-27(24,25)26)16-15-21-14-13-20(28-21)12-8-4-7-11-19-9-5-3-6-10-19/h13-14,19H,2-7,9-11,15-18,23H2,1H3,(H2,24,25,26)