ethyl 2-methyl-5-(1-thiophen-2-ylsulfonylpiperidin-4-yl)carbonyloxy-1H-indole-3-carboxylate

Systemtic Name: ethyl 2-methyl-5-(1-thiophen-2-ylsulfonylpiperidin-4-yl)carbonyloxy-1H-indole-3-carboxylate Openeye Name: ethyl 2-methyl-5-[1-(2-thienylsulfonyl)piperidine-4-carbonyl]oxy-1H-indole-3-carboxylate CAS Name: 2-methyl-5-[oxo-(1-thiophen-2-ylsulfonyl-4-piperidinyl)methoxy]-1H-indole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-5-(1-thiophen-2-ylsulfonylpiperidine-4-carbonyl)oxy-1H-indole-3-carboxylate Traditional Name: 2-methyl-5-[1-(2-thienylsulfonyl)isonipecotoyl]oxy-1H-indole-3-carboxylic acid ethyl ester Formula: C22H24N2O6S2 MolecularWeight: 476.56576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C1C=C(C=C2)OC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4)C

Isomeric SMILES

CCOC(=O)C1=C(NC2=C1C=C(C=C2)OC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4)C

InChI

InChI=1S/C22H24N2O6S2/c1-3-29-22(26)20-14(2)23-18-7-6-16(13-17(18)20)30-21(25)15-8-10-24(11-9-15)32(27,28)19-5-4-12-31-19/h4-7,12-13,15,23H,3,8-11H2,1-2H3