[4-[[(4-azanylcyclohexyl)-(3-phenylprop-2-enyl)amino]methyl]phenyl]methylphosphonic acid

Systemtic Name: [4-[[(4-azanylcyclohexyl)-(3-phenylprop-2-enyl)amino]methyl]phenyl]methylphosphonic acid Openeye Name: [4-[[(4-aminocyclohexyl)-cinnamyl-amino]methyl]phenyl]methylphosphonic acid CAS Name: [4-[[(4-aminocyclohexyl)-(3-phenylprop-2-enyl)amino]methyl]phenyl]methylphosphonic acid IUPAC Name: [4-[[(4-aminocyclohexyl)-(3-phenylprop-2-enyl)amino]methyl]phenyl]methylphosphonic acid Traditional Name: [4-[[(4-aminocyclohexyl)-cinnamyl-amino]methyl]benzyl]phosphonic acid Formula: C23H31N2O3P MolecularWeight: 414.477601

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)N(CC=CC2=CC=CC=C2)CC3=CC=C(C=C3)CP(=O)(O)O

Isomeric SMILES

C1CC(CCC1N)N(CC=CC2=CC=CC=C2)CC3=CC=C(C=C3)CP(=O)(O)O

InChI

InChI=1S/C23H31N2O3P/c24-22-12-14-23(15-13-22)25(16-4-7-19-5-2-1-3-6-19)17-20-8-10-21(11-9-20)18-29(26,27)28/h1-11,22-23H,12-18,24H2,(H2,26,27,28)