methyl 1,1-bis(oxidanylidene)-4-pentanoyloxy-2-propan-2-yl-1$l^{6},2-benzothiazine-3-carboxylate

Systemtic Name: methyl 1,1-bis(oxidanylidene)-4-pentanoyloxy-2-propan-2-yl-1$l^{6},2-benzothiazine-3-carboxylate Openeye Name: methyl 2-isopropyl-1,1-dioxo-4-pentanoyloxy-1$l^{6},2-benzothiazine-3-carboxylate CAS Name: 1,1-dioxo-4-(1-oxopentoxy)-2-propan-2-yl-1$l^{6},2-benzothiazine-3-carboxylic acid methyl ester IUPAC Name: methyl 1,1-dioxo-4-pentanoyloxy-2-propan-2-yl-1$l^{6},2-benzothiazine-3-carboxylate Traditional Name: 2-isopropyl-1,1-diketo-4-valeryloxy-1$l^{6},2-benzothiazine-3-carboxylic acid methyl ester Formula: C18H23NO6S MolecularWeight: 381.44332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1=C(N(S(=O)(=O)C2=CC=CC=C21)C(C)C)C(=O)OC

Isomeric SMILES

CCCCC(=O)OC1=C(N(S(=O)(=O)C2=CC=CC=C21)C(C)C)C(=O)OC

InChI

InChI=1S/C18H23NO6S/c1-5-6-11-15(20)25-17-13-9-7-8-10-14(13)26(22,23)19(12(2)3)16(17)18(21)24-4/h7-10,12H,5-6,11H2,1-4H3