[3-[(3-methoxyphenyl)carbonylamino]phenyl] 4-bromanyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: [3-[(3-methoxyphenyl)carbonylamino]phenyl] 4-bromanyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: [3-[(3-methoxybenzoyl)amino]phenyl] 4-bromo-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-bromo-3-(1-piperidinylsulfonyl)benzoic acid [3-[[(3-methoxyphenyl)-oxomethyl]amino]phenyl] ester IUPAC Name: [3-[(3-methoxybenzoyl)amino]phenyl] 4-bromo-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-bromo-3-piperidinosulfonyl-benzoic acid [3-(m-anisoylamino)phenyl] ester Formula: C26H25BrN2O6S MolecularWeight: 573.4555

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC2=CC(=CC=C2)OC(=O)C3=CC(=C(C=C3)Br)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC2=CC(=CC=C2)OC(=O)C3=CC(=C(C=C3)Br)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C26H25BrN2O6S/c1-34-21-9-5-7-18(15-21)25(30)28-20-8-6-10-22(17-20)35-26(31)19-11-12-23(27)24(16-19)36(32,33)29-13-3-2-4-14-29/h5-12,15-17H,2-4,13-14H2,1H3,(H,28,30)