(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 4-methylbenzoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 4-methylbenzoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 4-methylbenzoate Traditional Name: 4-methylbenzoic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C22H17NO3S MolecularWeight: 375.44028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17NO3S/c1-15-10-12-16(13-11-15)22(25)26-14-21(24)23-17-6-2-4-8-19(17)27-20-9-5-3-7-18(20)23/h2-13H,14H2,1H3