[3-azanyl-3-methyl-5-[5-(4-phenylbutanoyl)thiophen-2-yl]pentyl]phosphonic acid

Systemtic Name: [3-azanyl-3-methyl-5-[5-(4-phenylbutanoyl)thiophen-2-yl]pentyl]phosphonic acid Openeye Name: [3-amino-3-methyl-5-[5-(4-phenylbutanoyl)-2-thienyl]pentyl]phosphonic acid CAS Name: [3-amino-3-methyl-5-[5-(1-oxo-4-phenylbutyl)-2-thiophenyl]pentyl]phosphonic acid IUPAC Name: [3-amino-3-methyl-5-[5-(4-phenylbutanoyl)thiophen-2-yl]pentyl]phosphonic acid Traditional Name: [3-amino-3-methyl-5-[5-(4-phenylbutanoyl)-2-thienyl]pentyl]phosphonic acid Formula: C20H28NO4PS MolecularWeight: 409.479381

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(S1)C(=O)CCCC2=CC=CC=C2)(CCP(=O)(O)O)N

Isomeric SMILES

CC(CCC1=CC=C(S1)C(=O)CCCC2=CC=CC=C2)(CCP(=O)(O)O)N

InChI

InChI=1S/C20H28NO4PS/c1-20(21,14-15-26(23,24)25)13-12-17-10-11-19(27-17)18(22)9-5-8-16-6-3-2-4-7-16/h2-4,6-7,10-11H,5,8-9,12-15,21H2,1H3,(H2,23,24,25)