[4-[[(4-azanylcyclohexyl)-(thiophen-2-ylmethyl)amino]methyl]phenyl]methylphosphonic acid

Systemtic Name: [4-[[(4-azanylcyclohexyl)-(thiophen-2-ylmethyl)amino]methyl]phenyl]methylphosphonic acid Openeye Name: [4-[[(4-aminocyclohexyl)-(2-thienylmethyl)amino]methyl]phenyl]methylphosphonic acid CAS Name: [4-[[(4-aminocyclohexyl)-(thiophen-2-ylmethyl)amino]methyl]phenyl]methylphosphonic acid IUPAC Name: [4-[[(4-aminocyclohexyl)-(thiophen-2-ylmethyl)amino]methyl]phenyl]methylphosphonic acid Traditional Name: [4-[[(4-aminocyclohexyl)-(2-thenyl)amino]methyl]benzyl]phosphonic acid Formula: C19H27N2O3PS MolecularWeight: 394.468041

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)N(CC2=CC=C(C=C2)CP(=O)(O)O)CC3=CC=CS3

Isomeric SMILES

C1CC(CCC1N)N(CC2=CC=C(C=C2)CP(=O)(O)O)CC3=CC=CS3

InChI

InChI=1S/C19H27N2O3PS/c20-17-7-9-18(10-8-17)21(13-19-2-1-11-26-19)12-15-3-5-16(6-4-15)14-25(22,23)24/h1-6,11,17-18H,7-10,12-14,20H2,(H2,22,23,24)