diethyl 2-(2-phenothiazin-10-ylethyl)propanedioate

Systemtic Name: diethyl 2-(2-phenothiazin-10-ylethyl)propanedioate Openeye Name: diethyl 2-(2-phenothiazin-10-ylethyl)propanedioate CAS Name: 2-[2-(10-phenothiazinyl)ethyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-(2-phenothiazin-10-ylethyl)propanedioate Traditional Name: 2-(2-phenothiazin-10-ylethyl)malonic acid diethyl ester Formula: C21H23NO4S MolecularWeight: 385.47662

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCN1C2=CC=CC=C2SC3=CC=CC=C31)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CCN1C2=CC=CC=C2SC3=CC=CC=C31)C(=O)OCC

InChI

InChI=1S/C21H23NO4S/c1-3-25-20(23)15(21(24)26-4-2)13-14-22-16-9-5-7-11-18(16)27-19-12-8-6-10-17(19)22/h5-12,15H,3-4,13-14H2,1-2H3