(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-(2-oxidanylideneazepan-1-yl)ethanoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-(2-oxidanylideneazepan-1-yl)ethanoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 2-(2-oxoazepan-1-yl)acetate CAS Name: 2-(2-oxo-1-azepanyl)acetic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 2-(2-oxoazepan-1-yl)acetate Traditional Name: 2-(2-ketoazepan-1-yl)acetic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CC(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42

Isomeric SMILES

C1CCC(=O)N(CC1)CC(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42

InChI

InChI=1S/C22H22N2O4S/c25-20-12-2-1-7-13-23(20)14-22(27)28-15-21(26)24-16-8-3-5-10-18(16)29-19-11-6-4-9-17(19)24/h3-6,8-11H,1-2,7,12-15H2