[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl] 5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-benzoate

Systemtic Name: [2-(1H-indol-3-yl)-2-oxidanylidene-ethyl] 5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-benzoate Openeye Name: [2-(1H-indol-3-yl)-2-oxo-ethyl] 5-morpholinosulfonyl-2-(1-piperidyl)benzoate CAS Name: 5-(4-morpholinylsulfonyl)-2-(1-piperidinyl)benzoic acid [2-(1H-indol-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(1H-indol-3-yl)-2-oxoethyl] 5-morpholin-4-ylsulfonyl-2-piperidin-1-ylbenzoate Traditional Name: 5-morpholinosulfonyl-2-piperidino-benzoic acid [2-(1H-indol-3-yl)-2-keto-ethyl] ester Formula: C26H29N3O6S MolecularWeight: 511.58996

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)OCC(=O)C4=CNC5=CC=CC=C54

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)OCC(=O)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C26H29N3O6S/c30-25(22-17-27-23-7-3-2-6-20(22)23)18-35-26(31)21-16-19(36(32,33)29-12-14-34-15-13-29)8-9-24(21)28-10-4-1-5-11-28/h2-3,6-9,16-17,27H,1,4-5,10-15,18H2