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

Systemtic Name: [4-[[2-azanylethyl-[(4-propan-2-ylphenyl)methyl]amino]methyl]phenyl]methylphosphonic acid Openeye Name: [4-[[2-aminoethyl-[(4-isopropylphenyl)methyl]amino]methyl]phenyl]methylphosphonic acid CAS Name: [4-[[2-aminoethyl-[(4-propan-2-ylphenyl)methyl]amino]methyl]phenyl]methylphosphonic acid IUPAC Name: [4-[[2-aminoethyl-[(4-propan-2-ylphenyl)methyl]amino]methyl]phenyl]methylphosphonic acid Traditional Name: [4-[[2-aminoethyl-(4-isopropylbenzyl)amino]methyl]benzyl]phosphonic acid Formula: C20H29N2O3P MolecularWeight: 376.429621

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN(CCN)CC2=CC=C(C=C2)CP(=O)(O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN(CCN)CC2=CC=C(C=C2)CP(=O)(O)O

InChI

InChI=1S/C20H29N2O3P/c1-16(2)20-9-7-18(8-10-20)14-22(12-11-21)13-17-3-5-19(6-4-17)15-26(23,24)25/h3-10,16H,11-15,21H2,1-2H3,(H2,23,24,25)