[3-azanyl-5-[5-(6-cyclohexylhexanoyl)thiophen-2-yl]-3-ethyl-pentyl]phosphonic acid

Systemtic Name: [3-azanyl-5-[5-(6-cyclohexylhexanoyl)thiophen-2-yl]-3-ethyl-pentyl]phosphonic acid Openeye Name: [3-amino-5-[5-(6-cyclohexylhexanoyl)-2-thienyl]-3-ethyl-pentyl]phosphonic acid CAS Name: [3-amino-5-[5-(6-cyclohexyl-1-oxohexyl)-2-thiophenyl]-3-ethylpentyl]phosphonic acid IUPAC Name: [3-amino-5-[5-(6-cyclohexylhexanoyl)thiophen-2-yl]-3-ethylpentyl]phosphonic acid Traditional Name: [3-amino-5-[5-(6-cyclohexylhexanoyl)-2-thienyl]-3-ethyl-pentyl]phosphonic acid Formula: C23H40NO4PS MolecularWeight: 457.606761

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1=CC=C(S1)C(=O)CCCCCC2CCCCC2)(CCP(=O)(O)O)N

Isomeric SMILES

CCC(CCC1=CC=C(S1)C(=O)CCCCCC2CCCCC2)(CCP(=O)(O)O)N

InChI

InChI=1S/C23H40NO4PS/c1-2-23(24,17-18-29(26,27)28)16-15-20-13-14-22(30-20)21(25)12-8-4-7-11-19-9-5-3-6-10-19/h13-14,19H,2-12,15-18,24H2,1H3,(H2,26,27,28)