[2,3-dihydro-1,4-benzodioxin-6-yl-[(4-ethylphenyl)amino]methyl]phosphonic acid

Systemtic Name: [2,3-dihydro-1,4-benzodioxin-6-yl-[(4-ethylphenyl)amino]methyl]phosphonic acid Openeye Name: [2,3-dihydro-1,4-benzodioxin-6-yl-(4-ethylanilino)methyl]phosphonic acid CAS Name: [2,3-dihydro-1,4-benzodioxin-6-yl-(4-ethylanilino)methyl]phosphonic acid IUPAC Name: [2,3-dihydro-1,4-benzodioxin-6-yl-(4-ethylanilino)methyl]phosphonic acid Traditional Name: [2,3-dihydro-1,4-benzodioxin-6-yl-(4-ethylanilino)methyl]phosphonic acid Formula: C17H20NO5P MolecularWeight: 349.318161

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(C2=CC3=C(C=C2)OCCO3)P(=O)(O)O

Isomeric SMILES

CCC1=CC=C(C=C1)NC(C2=CC3=C(C=C2)OCCO3)P(=O)(O)O

InChI

InChI=1S/C17H20NO5P/c1-2-12-3-6-14(7-4-12)18-17(24(19,20)21)13-5-8-15-16(11-13)23-10-9-22-15/h3-8,11,17-18H,2,9-10H2,1H3,(H2,19,20,21)