[4-[[3-azanylpropyl-[(3-methylthiophen-2-yl)methyl]amino]methyl]phenyl]methylphosphonic acid

Systemtic Name: [4-[[3-azanylpropyl-[(3-methylthiophen-2-yl)methyl]amino]methyl]phenyl]methylphosphonic acid Openeye Name: [4-[[3-aminopropyl-[(3-methyl-2-thienyl)methyl]amino]methyl]phenyl]methylphosphonic acid CAS Name: [4-[[3-aminopropyl-[(3-methyl-2-thiophenyl)methyl]amino]methyl]phenyl]methylphosphonic acid IUPAC Name: [4-[[3-aminopropyl-[(3-methylthiophen-2-yl)methyl]amino]methyl]phenyl]methylphosphonic acid Traditional Name: [4-[[3-aminopropyl-[(3-methyl-2-thienyl)methyl]amino]methyl]benzyl]phosphonic acid Formula: C17H25N2O3PS MolecularWeight: 368.430761

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(CCCN)CC2=CC=C(C=C2)CP(=O)(O)O

Isomeric SMILES

CC1=C(SC=C1)CN(CCCN)CC2=CC=C(C=C2)CP(=O)(O)O

InChI

InChI=1S/C17H25N2O3PS/c1-14-7-10-24-17(14)12-19(9-2-8-18)11-15-3-5-16(6-4-15)13-23(20,21)22/h3-7,10H,2,8-9,11-13,18H2,1H3,(H2,20,21,22)