1,11-dimethoxy-N-[(1S)-1-phenylethyl]-6-sulfanylidene-benzo[d][1,3,2]benzodioxaphosphepin-6-amine

Systemtic Name: 1,11-dimethoxy-N-[(1S)-1-phenylethyl]-6-sulfanylidene-benzo[d][1,3,2]benzodioxaphosphepin-6-amine Openeye Name: 1,11-dimethoxy-N-[(1S)-1-phenylethyl]-6-thioxo-benzo[d][1,3,2]benzodioxaphosphepin-6-amine CAS Name: 1,11-dimethoxy-N-[(1S)-1-phenylethyl]-6-sulfanylidene-6-benzo[d][1,3,2]benzodioxaphosphepinamine IUPAC Name: 1,11-dimethoxy-N-[(1S)-1-phenylethyl]-6-sulfanylidenebenzo[d][1,3,2]benzodioxaphosphepin-6-amine Traditional Name: (1,11-dimethoxy-6-thioxo-benzo[d][1,3,2]benzodioxaphosphepin-6-yl)-[(1S)-1-phenylethyl]amine Formula: C22H22NO4PS MolecularWeight: 427.453141

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NP2(=S)OC3=C(C(=CC=C3)OC)C4=C(O2)C=CC=C4OC

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NP2(=S)OC3=C(C(=CC=C3)OC)C4=C(O2)C=CC=C4OC

InChI

InChI=1S/C22H22NO4PS/c1-15(16-9-5-4-6-10-16)23-28(29)26-19-13-7-11-17(24-2)21(19)22-18(25-3)12-8-14-20(22)27-28/h4-15H,1-3H3,(H,23,29)/t15-/m0/s1