methyl 4-[2-[(5-methyl-1,2-oxazol-3-yl)methylamino]-4-piperidin-1-ylsulfonyl-phenoxy]benzoate

Systemtic Name: methyl 4-[2-[(5-methyl-1,2-oxazol-3-yl)methylamino]-4-piperidin-1-ylsulfonyl-phenoxy]benzoate Openeye Name: methyl 4-[2-[(5-methylisoxazol-3-yl)methylamino]-4-(1-piperidylsulfonyl)phenoxy]benzoate CAS Name: 4-[2-[(5-methyl-3-isoxazolyl)methylamino]-4-(1-piperidinylsulfonyl)phenoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[(5-methyl-1,2-oxazol-3-yl)methylamino]-4-piperidin-1-ylsulfonylphenoxy]benzoate Traditional Name: 4-[2-[(5-methylisoxazol-3-yl)methylamino]-4-piperidinosulfonyl-phenoxy]benzoic acid methyl ester Formula: C24H27N3O6S MolecularWeight: 485.55268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CNC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)OC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=CC(=NO1)CNC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)OC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C24H27N3O6S/c1-17-14-19(26-33-17)16-25-22-15-21(34(29,30)27-12-4-3-5-13-27)10-11-23(22)32-20-8-6-18(7-9-20)24(28)31-2/h6-11,14-15,25H,3-5,12-13,16H2,1-2H3