[3-azanyl-5-[5-[5-(4-methoxyphenyl)pent-1-ynyl]thiophen-2-yl]-3-methyl-pentyl]phosphonic acid

Systemtic Name: [3-azanyl-5-[5-[5-(4-methoxyphenyl)pent-1-ynyl]thiophen-2-yl]-3-methyl-pentyl]phosphonic acid Openeye Name: [3-amino-5-[5-[5-(4-methoxyphenyl)pent-1-ynyl]-2-thienyl]-3-methyl-pentyl]phosphonic acid CAS Name: [3-amino-5-[5-[5-(4-methoxyphenyl)pent-1-ynyl]-2-thiophenyl]-3-methylpentyl]phosphonic acid IUPAC Name: [3-amino-5-[5-[5-(4-methoxyphenyl)pent-1-ynyl]thiophen-2-yl]-3-methylpentyl]phosphonic acid Traditional Name: [3-amino-5-[5-[5-(4-methoxyphenyl)pent-1-ynyl]-2-thienyl]-3-methyl-pentyl]phosphonic acid Formula: C22H30NO4PS MolecularWeight: 435.516661

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(S1)C#CCCCC2=CC=C(C=C2)OC)(CCP(=O)(O)O)N

Isomeric SMILES

CC(CCC1=CC=C(S1)C#CCCCC2=CC=C(C=C2)OC)(CCP(=O)(O)O)N

InChI

InChI=1S/C22H30NO4PS/c1-22(23,16-17-28(24,25)26)15-14-21-13-12-20(29-21)7-5-3-4-6-18-8-10-19(27-2)11-9-18/h8-13H,3-4,6,14-17,23H2,1-2H3,(H2,24,25,26)