(2-azanyl-4,5-dihydrobenzo[e][1,3]benzothiazol-7-yl)phosphonic acid

Systemtic Name: (2-azanyl-4,5-dihydrobenzo[e][1,3]benzothiazol-7-yl)phosphonic acid Openeye Name: (2-amino-4,5-dihydrobenzo[e][1,3]benzothiazol-7-yl)phosphonic acid CAS Name: (2-amino-4,5-dihydrobenzo[e][1,3]benzothiazol-7-yl)phosphonic acid IUPAC Name: (2-amino-4,5-dihydrobenzo[e][1,3]benzothiazol-7-yl)phosphonic acid Traditional Name: (2-amino-4,5-dihydrobenzo[e][1,3]benzothiazol-7-yl)phosphonic acid Formula: C11H11N2O3PS MolecularWeight: 282.255401

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=C1C=C(C=C3)P(=O)(O)O)N=C(S2)N

Isomeric SMILES

C1CC2=C(C3=C1C=C(C=C3)P(=O)(O)O)N=C(S2)N

InChI

InChI=1S/C11H11N2O3PS/c12-11-13-10-8-3-2-7(17(14,15)16)5-6(8)1-4-9(10)18-11/h2-3,5H,1,4H2,(H2,12,13)(H2,14,15,16)