methyl 4,5-dimethoxy-2-(3-phenothiazin-10-ylpropanoylamino)benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-(3-phenothiazin-10-ylpropanoylamino)benzoate Openeye Name: methyl 4,5-dimethoxy-2-(3-phenothiazin-10-ylpropanoylamino)benzoate CAS Name: 4,5-dimethoxy-2-[[1-oxo-3-(10-phenothiazinyl)propyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-(3-phenothiazin-10-ylpropanoylamino)benzoate Traditional Name: 4,5-dimethoxy-2-(3-phenothiazin-10-ylpropanoylamino)benzoic acid methyl ester Formula: C25H24N2O5S MolecularWeight: 464.53346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CCN2C3=CC=CC=C3SC4=CC=CC=C42)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CCN2C3=CC=CC=C3SC4=CC=CC=C42)OC

InChI

InChI=1S/C25H24N2O5S/c1-30-20-14-16(25(29)32-3)17(15-21(20)31-2)26-24(28)12-13-27-18-8-4-6-10-22(18)33-23-11-7-5-9-19(23)27/h4-11,14-15H,12-13H2,1-3H3,(H,26,28)