[2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)amino]ethyl] 3-phenothiazin-10-ylpropanoate

Systemtic Name: [2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)amino]ethyl] 3-phenothiazin-10-ylpropanoate Openeye Name: [2-oxo-2-(3,4,5-trimethoxyanilino)ethyl] 3-phenothiazin-10-ylpropanoate CAS Name: 3-(10-phenothiazinyl)propanoic acid [2-oxo-2-(3,4,5-trimethoxyanilino)ethyl] ester IUPAC Name: [2-oxo-2-(3,4,5-trimethoxyanilino)ethyl] 3-phenothiazin-10-ylpropanoate Traditional Name: 3-phenothiazin-10-ylpropionic acid [2-keto-2-(3,4,5-trimethoxyanilino)ethyl] ester Formula: C26H26N2O6S MolecularWeight: 494.55944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)COC(=O)CCN2C3=CC=CC=C3SC4=CC=CC=C42

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)COC(=O)CCN2C3=CC=CC=C3SC4=CC=CC=C42

InChI

InChI=1S/C26H26N2O6S/c1-31-20-14-17(15-21(32-2)26(20)33-3)27-24(29)16-34-25(30)12-13-28-18-8-4-6-10-22(18)35-23-11-7-5-9-19(23)28/h4-11,14-15H,12-13,16H2,1-3H3,(H,27,29)