(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 4-(4-methylphenyl)benzoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 4-(4-methylphenyl)benzoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 4-(p-tolyl)benzoate CAS Name: 4-(4-methylphenyl)benzoic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 4-(4-methylphenyl)benzoate Traditional Name: 4-(p-tolyl)benzoic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C28H21NO3S MolecularWeight: 451.53624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C28H21NO3S/c1-19-10-12-20(13-11-19)21-14-16-22(17-15-21)28(31)32-18-27(30)29-23-6-2-4-8-25(23)33-26-9-5-3-7-24(26)29/h2-17H,18H2,1H3