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

Systemtic Name: [3-azanyl-3-methyl-5-[5-(4-phenylmethoxyphenyl)thiophen-2-yl]pentyl]phosphonic acid Openeye Name: [3-amino-5-[5-(4-benzyloxyphenyl)-2-thienyl]-3-methyl-pentyl]phosphonic acid CAS Name: [3-amino-3-methyl-5-[5-(4-phenylmethoxyphenyl)-2-thiophenyl]pentyl]phosphonic acid IUPAC Name: [3-amino-3-methyl-5-[5-(4-phenylmethoxyphenyl)thiophen-2-yl]pentyl]phosphonic acid Traditional Name: [3-amino-5-[5-(4-benzoxyphenyl)-2-thienyl]-3-methyl-pentyl]phosphonic acid Formula: C23H28NO4PS MolecularWeight: 445.511481

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(S1)C2=CC=C(C=C2)OCC3=CC=CC=C3)(CCP(=O)(O)O)N

Isomeric SMILES

CC(CCC1=CC=C(S1)C2=CC=C(C=C2)OCC3=CC=CC=C3)(CCP(=O)(O)O)N

InChI

InChI=1S/C23H28NO4PS/c1-23(24,15-16-29(25,26)27)14-13-21-11-12-22(30-21)19-7-9-20(10-8-19)28-17-18-5-3-2-4-6-18/h2-12H,13-17,24H2,1H3,(H2,25,26,27)