[2-butyl-1,1-bis(oxidanylidene)-1$l^{6},2-benzothiazin-4-yl] 4-methylbenzoate

Systemtic Name: [2-butyl-1,1-bis(oxidanylidene)-1$l^{6},2-benzothiazin-4-yl] 4-methylbenzoate Openeye Name: (2-butyl-1,1-dioxo-1$l^{6},2-benzothiazin-4-yl) 4-methylbenzoate CAS Name: 4-methylbenzoic acid (2-butyl-1,1-dioxo-1$l^{6},2-benzothiazin-4-yl) ester IUPAC Name: (2-butyl-1,1-dioxo-1$l^{6},2-benzothiazin-4-yl) 4-methylbenzoate Traditional Name: 4-methylbenzoic acid (2-butyl-1,1-diketo-1$l^{6},2-benzothiazin-4-yl) ester Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C2=CC=CC=C2S1(=O)=O)OC(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCN1C=C(C2=CC=CC=C2S1(=O)=O)OC(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H21NO4S/c1-3-4-13-21-14-18(17-7-5-6-8-19(17)26(21,23)24)25-20(22)16-11-9-15(2)10-12-16/h5-12,14H,3-4,13H2,1-2H3