(2-azanyl-4,5-dihydrobenzo[e][1,3]benzothiazol-9-yl)phosphonic acid

Systemtic Name: (2-azanyl-4,5-dihydrobenzo[e][1,3]benzothiazol-9-yl)phosphonic acid Openeye Name: (2-amino-4,5-dihydrobenzo[e][1,3]benzothiazol-9-yl)phosphonic acid CAS Name: (2-amino-4,5-dihydrobenzo[e][1,3]benzothiazol-9-yl)phosphonic acid IUPAC Name: (2-amino-4,5-dihydrobenzo[e][1,3]benzothiazol-9-yl)phosphonic acid Traditional Name: (2-amino-4,5-dihydrobenzo[e][1,3]benzothiazol-9-yl)phosphonic acid Formula: C11H11N2O3PS MolecularWeight: 282.255401

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=C1C=CC=C3P(=O)(O)O)N=C(S2)N

Isomeric SMILES

C1CC2=C(C3=C1C=CC=C3P(=O)(O)O)N=C(S2)N

InChI

InChI=1S/C11H11N2O3PS/c12-11-13-10-8(18-11)5-4-6-2-1-3-7(9(6)10)17(14,15)16/h1-3H,4-5H2,(H2,12,13)(H2,14,15,16)