methyl 3-cyclopropyl-2-[(4-ethoxycarbonylphenyl)amino]-4-oxidanylidene-1,3-thiazin-3-ium-6-carboxylate

Systemtic Name: methyl 3-cyclopropyl-2-[(4-ethoxycarbonylphenyl)amino]-4-oxidanylidene-1,3-thiazin-3-ium-6-carboxylate Openeye Name: methyl 3-cyclopropyl-2-(4-ethoxycarbonylanilino)-4-oxo-1,3-thiazin-3-ium-6-carboxylate CAS Name: 3-cyclopropyl-2-(4-ethoxycarbonylanilino)-4-oxo-1,3-thiazin-3-ium-6-carboxylic acid methyl ester IUPAC Name: methyl 3-cyclopropyl-2-(4-ethoxycarbonylanilino)-4-oxo-1,3-thiazin-3-ium-6-carboxylate Traditional Name: 2-(4-carbethoxyanilino)-3-cyclopropyl-4-keto-1,3-thiazin-3-ium-6-carboxylic acid methyl ester Formula: C18H19N2O5S+ MolecularWeight: 375.41886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=[N+](C(=O)C=C(S2)C(=O)OC)C3CC3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=[N+](C(=O)C=C(S2)C(=O)OC)C3CC3

InChI

InChI=1S/C18H18N2O5S/c1-3-25-16(22)11-4-6-12(7-5-11)19-18-20(13-8-9-13)15(21)10-14(26-18)17(23)24-2/h4-7,10,13H,3,8-9H2,1-2H3/p+1