(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-[(3,4-dimethoxyphenyl)carbonylamino]ethanoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-[(3,4-dimethoxyphenyl)carbonylamino]ethanoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 2-[(3,4-dimethoxybenzoyl)amino]acetate CAS Name: 2-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]acetic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 2-[(3,4-dimethoxybenzoyl)amino]acetate Traditional Name: 2-(veratroylamino)acetic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C25H22N2O6S MolecularWeight: 478.51698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)OC

InChI

InChI=1S/C25H22N2O6S/c1-31-19-12-11-16(13-20(19)32-2)25(30)26-14-24(29)33-15-23(28)27-17-7-3-5-9-21(17)34-22-10-6-4-8-18(22)27/h3-13H,14-15H2,1-2H3,(H,26,30)