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

Systemtic Name: [3-azanyl-5-[5-[4-(3-methoxyphenoxy)butanoyl]thiophen-2-yl]-3-methyl-pentyl]phosphonic acid Openeye Name: [3-amino-5-[5-[4-(3-methoxyphenoxy)butanoyl]-2-thienyl]-3-methyl-pentyl]phosphonic acid CAS Name: [3-amino-5-[5-[4-(3-methoxyphenoxy)-1-oxobutyl]-2-thiophenyl]-3-methylpentyl]phosphonic acid IUPAC Name: [3-amino-5-[5-[4-(3-methoxyphenoxy)butanoyl]thiophen-2-yl]-3-methylpentyl]phosphonic acid Traditional Name: [3-amino-5-[5-[4-(3-methoxyphenoxy)butanoyl]-2-thienyl]-3-methyl-pentyl]phosphonic acid Formula: C21H30NO6PS MolecularWeight: 455.504761

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(S1)C(=O)CCCOC2=CC=CC(=C2)OC)(CCP(=O)(O)O)N

Isomeric SMILES

CC(CCC1=CC=C(S1)C(=O)CCCOC2=CC=CC(=C2)OC)(CCP(=O)(O)O)N

InChI

InChI=1S/C21H30NO6PS/c1-21(22,12-14-29(24,25)26)11-10-18-8-9-20(30-18)19(23)7-4-13-28-17-6-3-5-16(15-17)27-2/h3,5-6,8-9,15H,4,7,10-14,22H2,1-2H3,(H2,24,25,26)