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

Systemtic Name: [3-azanyl-3-methyl-5-[5-(4-phenylbut-1-ynyl)thiophen-2-yl]pentyl]phosphonic acid Openeye Name: [3-amino-3-methyl-5-[5-(4-phenylbut-1-ynyl)-2-thienyl]pentyl]phosphonic acid CAS Name: [3-amino-3-methyl-5-[5-(4-phenylbut-1-ynyl)-2-thiophenyl]pentyl]phosphonic acid IUPAC Name: [3-amino-3-methyl-5-[5-(4-phenylbut-1-ynyl)thiophen-2-yl]pentyl]phosphonic acid Traditional Name: [3-amino-3-methyl-5-[5-(4-phenylbut-1-ynyl)-2-thienyl]pentyl]phosphonic acid Formula: C20H26NO3PS MolecularWeight: 391.464101

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26NO3PS/c1-20(21,15-16-25(22,23)24)14-13-19-12-11-18(26-19)10-6-5-9-17-7-3-2-4-8-17/h2-4,7-8,11-12H,5,9,13-16,21H2,1H3,(H2,22,23,24)