[3-azanyl-5-[3-[5-(4-ethylphenyl)pentanoyl]-2H-thiopyran-6-yl]-3-methyl-pentyl]phosphonic acid

Systemtic Name: [3-azanyl-5-[3-[5-(4-ethylphenyl)pentanoyl]-2H-thiopyran-6-yl]-3-methyl-pentyl]phosphonic acid Openeye Name: [3-amino-5-[3-[5-(4-ethylphenyl)pentanoyl]-2H-thiopyran-6-yl]-3-methyl-pentyl]phosphonic acid CAS Name: [3-amino-5-[3-[5-(4-ethylphenyl)-1-oxopentyl]-2H-thiopyran-6-yl]-3-methylpentyl]phosphonic acid IUPAC Name: [3-amino-5-[3-[5-(4-ethylphenyl)pentanoyl]-2H-thiopyran-6-yl]-3-methylpentyl]phosphonic acid Traditional Name: [3-amino-5-[3-[5-(4-ethylphenyl)pentanoyl]-2H-thiopyran-6-yl]-3-methyl-pentyl]phosphonic acid Formula: C24H36NO4PS MolecularWeight: 465.585701

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CCCCC(=O)C2=CC=C(SC2)CCC(C)(CCP(=O)(O)O)N

Isomeric SMILES

CCC1=CC=C(C=C1)CCCCC(=O)C2=CC=C(SC2)CCC(C)(CCP(=O)(O)O)N

InChI

InChI=1S/C24H36NO4PS/c1-3-19-8-10-20(11-9-19)6-4-5-7-23(26)21-12-13-22(31-18-21)14-15-24(2,25)16-17-30(27,28)29/h8-13H,3-7,14-18,25H2,1-2H3,(H2,27,28,29)