ethyl (2R,3S)-2-methyl-4-oxidanylidene-1,2,3,10-tetrahydrophenothiazine-3-carboxylate

Systemtic Name: ethyl (2R,3S)-2-methyl-4-oxidanylidene-1,2,3,10-tetrahydrophenothiazine-3-carboxylate Openeye Name: ethyl (2R,3S)-2-methyl-4-oxo-1,2,3,10-tetrahydrophenothiazine-3-carboxylate CAS Name: (2R,3S)-2-methyl-4-oxo-1,2,3,10-tetrahydrophenothiazine-3-carboxylic acid ethyl ester IUPAC Name: ethyl (2R,3S)-2-methyl-4-oxo-1,2,3,10-tetrahydrophenothiazine-3-carboxylate Traditional Name: (2R,3S)-4-keto-2-methyl-1,2,3,10-tetrahydrophenothiazine-3-carboxylic acid ethyl ester Formula: C16H17NO3S MolecularWeight: 303.37608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CC2=C(C1=O)SC3=CC=CC=C3N2)C

Isomeric SMILES

CCOC(=O)[C@H]1[C@@H](CC2=C(C1=O)SC3=CC=CC=C3N2)C

InChI

InChI=1S/C16H17NO3S/c1-3-20-16(19)13-9(2)8-11-15(14(13)18)21-12-7-5-4-6-10(12)17-11/h4-7,9,13,17H,3,8H2,1-2H3/t9-,13+/m1/s1