(2-oxidanylidene-1,2-diphenyl-ethyl) 3-phenothiazin-10-ylpropanoate

Systemtic Name: (2-oxidanylidene-1,2-diphenyl-ethyl) 3-phenothiazin-10-ylpropanoate Openeye Name: (2-oxo-1,2-diphenyl-ethyl) 3-phenothiazin-10-ylpropanoate CAS Name: 3-(10-phenothiazinyl)propanoic acid (2-oxo-1,2-diphenylethyl) ester IUPAC Name: (2-oxo-1,2-diphenylethyl) 3-phenothiazin-10-ylpropanoate Traditional Name: 3-phenothiazin-10-ylpropionic acid desyl ester Formula: C29H23NO3S MolecularWeight: 465.56282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)OC(=O)CCN3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)OC(=O)CCN3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C29H23NO3S/c31-27(33-29(22-13-5-2-6-14-22)28(32)21-11-3-1-4-12-21)19-20-30-23-15-7-9-17-25(23)34-26-18-10-8-16-24(26)30/h1-18,29H,19-20H2