methyl 2-[2-ethylbutyl-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)carbonyl-amino]ethanoate

Systemtic Name: methyl 2-[2-ethylbutyl-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)carbonyl-amino]ethanoate Openeye Name: methyl 2-[2-ethylbutyl-[2-methyl-5-(1-piperidylsulfonyl)benzoyl]amino]acetate CAS Name: 2-[2-ethylbutyl-[[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[2-ethylbutyl-(2-methyl-5-piperidin-1-ylsulfonylbenzoyl)amino]acetate Traditional Name: 2-[2-ethylbutyl-(2-methyl-5-piperidinosulfonyl-benzoyl)amino]acetic acid methyl ester Formula: C22H34N2O5S MolecularWeight: 438.58076

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CN(CC(=O)OC)C(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)C

Isomeric SMILES

CCC(CC)CN(CC(=O)OC)C(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)C

InChI

InChI=1S/C22H34N2O5S/c1-5-18(6-2)15-23(16-21(25)29-4)22(26)20-14-19(11-10-17(20)3)30(27,28)24-12-8-7-9-13-24/h10-11,14,18H,5-9,12-13,15-16H2,1-4H3