(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2,4,6-trimethylbenzoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2,4,6-trimethylbenzoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 2,4,6-trimethylbenzoate CAS Name: 2,4,6-trimethylbenzoic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 2,4,6-trimethylbenzoate Traditional Name: 2,4,6-trimethylbenzoic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C24H21NO3S MolecularWeight: 403.49344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)C

InChI

InChI=1S/C24H21NO3S/c1-15-12-16(2)23(17(3)13-15)24(27)28-14-22(26)25-18-8-4-6-10-20(18)29-21-11-7-5-9-19(21)25/h4-13H,14H2,1-3H3