[4-[[2-azanylethyl(cyclohexylcarbonyl)amino]methyl]phenyl]methylphosphonic acid

Systemtic Name: [4-[[2-azanylethyl(cyclohexylcarbonyl)amino]methyl]phenyl]methylphosphonic acid Openeye Name: [4-[[2-aminoethyl(cyclohexanecarbonyl)amino]methyl]phenyl]methylphosphonic acid CAS Name: [4-[[2-aminoethyl-[cyclohexyl(oxo)methyl]amino]methyl]phenyl]methylphosphonic acid IUPAC Name: [4-[[2-aminoethyl(cyclohexanecarbonyl)amino]methyl]phenyl]methylphosphonic acid Traditional Name: [4-[[2-aminoethyl(cyclohexanecarbonyl)amino]methyl]benzyl]phosphonic acid Formula: C17H27N2O4P MolecularWeight: 354.381041

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N(CCN)CC2=CC=C(C=C2)CP(=O)(O)O

Isomeric SMILES

C1CCC(CC1)C(=O)N(CCN)CC2=CC=C(C=C2)CP(=O)(O)O

InChI

InChI=1S/C17H27N2O4P/c18-10-11-19(17(20)16-4-2-1-3-5-16)12-14-6-8-15(9-7-14)13-24(21,22)23/h6-9,16H,1-5,10-13,18H2,(H2,21,22,23)