[4-[[3-azanylpropyl(cyclohexylcarbonyl)amino]methyl]phenyl]methylphosphonic acid

Systemtic Name: [4-[[3-azanylpropyl(cyclohexylcarbonyl)amino]methyl]phenyl]methylphosphonic acid Openeye Name: [4-[[3-aminopropyl(cyclohexanecarbonyl)amino]methyl]phenyl]methylphosphonic acid CAS Name: [4-[[3-aminopropyl-[cyclohexyl(oxo)methyl]amino]methyl]phenyl]methylphosphonic acid IUPAC Name: [4-[[3-aminopropyl(cyclohexanecarbonyl)amino]methyl]phenyl]methylphosphonic acid Traditional Name: [4-[[3-aminopropyl(cyclohexanecarbonyl)amino]methyl]benzyl]phosphonic acid Formula: C18H29N2O4P MolecularWeight: 368.407621

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29N2O4P/c19-11-4-12-20(18(21)17-5-2-1-3-6-17)13-15-7-9-16(10-8-15)14-25(22,23)24/h7-10,17H,1-6,11-14,19H2,(H2,22,23,24)