(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 4-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]-1,2,3,10-tetrahydroacridine-9-carboxylate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 4-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]-1,2,3,10-tetrahydroacridine-9-carboxylate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 4-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-1,2,3,10-tetrahydroacridine-9-carboxylate CAS Name: 4-[(4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-1,2,3,10-tetrahydroacridine-9-carboxylic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 4-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-1,2,3,10-tetrahydroacridine-9-carboxylate Traditional Name: 4-[(4-ketocyclohexa-2,5-dien-1-ylidene)methyl]-1,2,3,10-tetrahydroacridine-9-carboxylic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C35H26N2O4S MolecularWeight: 570.65694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C2C(=C(C3=CC=CC=C3N2)C(=O)OCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64)C1)C=C7C=CC(=O)C=C7

Isomeric SMILES

C1CC(=C2C(=C(C3=CC=CC=C3N2)C(=O)OCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64)C1)C=C7C=CC(=O)C=C7

InChI

InChI=1S/C35H26N2O4S/c38-24-18-16-22(17-19-24)20-23-8-7-10-26-33(25-9-1-2-11-27(25)36-34(23)26)35(40)41-21-32(39)37-28-12-3-5-14-30(28)42-31-15-6-4-13-29(31)37/h1-6,9,11-20,36H,7-8,10,21H2