N-[(S)-phosphonato(thiophen-2-yl)methyl]-2,3-dihydro-1,4-benzodioxin-6-amine

Systemtic Name: N-[(S)-phosphonato(thiophen-2-yl)methyl]-2,3-dihydro-1,4-benzodioxin-6-amine Openeye Name: N-[(S)-phosphonato(2-thienyl)methyl]-2,3-dihydro-1,4-benzodioxin-6-amine CAS Name: N-[(S)-phosphonato(thiophen-2-yl)methyl]-2,3-dihydro-1,4-benzodioxin-6-amine IUPAC Name: N-[(S)-phosphonato(thiophen-2-yl)methyl]-2,3-dihydro-1,4-benzodioxin-6-amine Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[(S)-phosphonato(2-thienyl)methyl]amine Formula: C13H12NO5PS-2 MolecularWeight: 325.276841

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(C3=CC=CS3)P(=O)([O-])[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)N[C@H](C3=CC=CS3)P(=O)([O-])[O-]

InChI

InChI=1S/C13H14NO5PS/c15-20(16,17)13(12-2-1-7-21-12)14-9-3-4-10-11(8-9)19-6-5-18-10/h1-4,7-8,13-14H,5-6H2,(H2,15,16,17)/p-2/t13-/m0/s1