[2-(naphthalen-2-ylamino)-2-oxidanylidene-ethyl] 3-bromanyl-5-(4-methylpiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: [2-(naphthalen-2-ylamino)-2-oxidanylidene-ethyl] 3-bromanyl-5-(4-methylpiperidin-1-yl)sulfonyl-benzoate Openeye Name: [2-(2-naphthylamino)-2-oxo-ethyl] 3-bromo-5-[(4-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 3-bromo-5-[(4-methyl-1-piperidinyl)sulfonyl]benzoic acid [2-(2-naphthalenylamino)-2-oxoethyl] ester IUPAC Name: [2-(naphthalen-2-ylamino)-2-oxoethyl] 3-bromo-5-(4-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 3-bromo-5-(4-methylpiperidino)sulfonyl-benzoic acid [2-keto-2-(2-naphthylamino)ethyl] ester Formula: C25H25BrN2O5S MolecularWeight: 545.4454

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=CC(=C2)C(=O)OCC(=O)NC3=CC4=CC=CC=C4C=C3)Br

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=CC(=C2)C(=O)OCC(=O)NC3=CC4=CC=CC=C4C=C3)Br

InChI

InChI=1S/C25H25BrN2O5S/c1-17-8-10-28(11-9-17)34(31,32)23-14-20(12-21(26)15-23)25(30)33-16-24(29)27-22-7-6-18-4-2-3-5-19(18)13-22/h2-7,12-15,17H,8-11,16H2,1H3,(H,27,29)