dimethyl (E)-2-(5-propan-2-ylidenebenzo[c][1,2]benzothiazin-6-yl)but-2-enedioate

Systemtic Name: dimethyl (E)-2-(5-propan-2-ylidenebenzo[c][1,2]benzothiazin-6-yl)but-2-enedioate Openeye Name: dimethyl (E)-2-(5-isopropylidenebenzo[c][1,2]benzothiazin-6-yl)but-2-enedioate CAS Name: (E)-2-(5-propan-2-ylidene-6-benzo[c][1,2]benzothiazinyl)-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (E)-2-(5-propan-2-ylidenebenzo[c][1,2]benzothiazin-6-yl)but-2-enedioate Traditional Name: (E)-2-(5-isopropylidenebenzo[c][1,2]benzothiazin-6-yl)but-2-enedioic acid dimethyl ester Formula: C21H21NO4S MolecularWeight: 383.46074

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S1C2=CC=CC=C2C3=CC=CC=C3N1C(=CC(=O)OC)C(=O)OC)C

Isomeric SMILES

CC(=S1C2=CC=CC=C2C3=CC=CC=C3N1/C(=C/C(=O)OC)/C(=O)OC)C

InChI

InChI=1S/C21H21NO4S/c1-14(2)27-19-12-8-6-10-16(19)15-9-5-7-11-17(15)22(27)18(21(24)26-4)13-20(23)25-3/h5-13H,1-4H3/b18-13+