(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 4-propan-2-ylbenzoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 4-propan-2-ylbenzoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 4-isopropylbenzoate CAS Name: 4-propan-2-ylbenzoic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 4-propan-2-ylbenzoate Traditional Name: 4-isopropylbenzoic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C24H21NO3S MolecularWeight: 403.49344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H21NO3S/c1-16(2)17-11-13-18(14-12-17)24(27)28-15-23(26)25-19-7-3-5-9-21(19)29-22-10-6-4-8-20(22)25/h3-14,16H,15H2,1-2H3