[2-[(4-methyl-2-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] (1R,2S)-2-methylcyclopropane-1-carboxylate

Systemtic Name: [2-[(4-methyl-2-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] (1R,2S)-2-methylcyclopropane-1-carboxylate Openeye Name: [2-[4-methyl-2-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl] (1R,2S)-2-methylcyclopropanecarboxylate CAS Name: (1R,2S)-2-methyl-1-cyclopropanecarboxylic acid [2-[4-methyl-2-(1-piperidinylsulfonyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-(4-methyl-2-piperidin-1-ylsulfonylanilino)-2-oxoethyl] (1R,2S)-2-methylcyclopropane-1-carboxylate Traditional Name: (1R,2S)-2-methylcyclopropanecarboxylic acid [2-keto-2-(4-methyl-2-piperidinosulfonyl-anilino)ethyl] ester Formula: C19H26N2O5S MolecularWeight: 394.48514

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1C(=O)OCC(=O)NC2=C(C=C(C=C2)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

C[C@H]1C[C@H]1C(=O)OCC(=O)NC2=C(C=C(C=C2)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H26N2O5S/c1-13-6-7-16(20-18(22)12-26-19(23)15-11-14(15)2)17(10-13)27(24,25)21-8-4-3-5-9-21/h6-7,10,14-15H,3-5,8-9,11-12H2,1-2H3,(H,20,22)/t14-,15+/m0/s1