methyl 2-[[2-(3-methylphenoxy)-5-piperidin-1-ylsulfonyl-phenyl]amino]ethanoate

Systemtic Name: methyl 2-[[2-(3-methylphenoxy)-5-piperidin-1-ylsulfonyl-phenyl]amino]ethanoate Openeye Name: methyl 2-[2-(3-methylphenoxy)-5-(1-piperidylsulfonyl)anilino]acetate CAS Name: 2-[2-(3-methylphenoxy)-5-(1-piperidinylsulfonyl)anilino]acetic acid methyl ester IUPAC Name: methyl 2-[2-(3-methylphenoxy)-5-piperidin-1-ylsulfonylanilino]acetate Traditional Name: 2-[2-(3-methylphenoxy)-5-piperidinosulfonyl-anilino]acetic acid methyl ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)NCC(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)NCC(=O)OC

InChI

InChI=1S/C21H26N2O5S/c1-16-7-6-8-17(13-16)28-20-10-9-18(14-19(20)22-15-21(24)27-2)29(25,26)23-11-4-3-5-12-23/h6-10,13-14,22H,3-5,11-12,15H2,1-2H3