ethyl 3-methyl-1-phenyl-thiopyrano[2,3-c]pyrazol-1-ium-5-carboxylate

Systemtic Name: ethyl 3-methyl-1-phenyl-thiopyrano[2,3-c]pyrazol-1-ium-5-carboxylate Openeye Name: ethyl 3-methyl-1-phenyl-thiopyrano[2,3-c]pyrazol-1-ium-5-carboxylate CAS Name: 3-methyl-1-phenyl-5-thiopyrano[2,3-c]pyrazol-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-1-phenylthiopyrano[2,3-c]pyrazol-1-ium-5-carboxylate Traditional Name: 3-methyl-1-phenyl-thiopyrano[2,3-c]pyrazol-1-ium-5-carboxylic acid ethyl ester Formula: C16H15N2O2S+ MolecularWeight: 299.3675

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC2=[N+](N=C(C2=C1)C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CSC2=[N+](N=C(C2=C1)C)C3=CC=CC=C3

InChI

InChI=1S/C16H15N2O2S/c1-3-20-16(19)12-9-14-11(2)17-18(15(14)21-10-12)13-7-5-4-6-8-13/h4-10H,3H2,1-2H3/q+1