[2-oxidanylidene-2-[(phenylmethyl)-propan-2-yl-amino]ethyl] 2-ethylsulfonylbenzoate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)-propan-2-yl-amino]ethyl] 2-ethylsulfonylbenzoate Openeye Name: [2-[benzyl(isopropyl)amino]-2-oxo-ethyl] 2-ethylsulfonylbenzoate CAS Name: 2-ethylsulfonylbenzoic acid [2-oxo-2-[(phenylmethyl)-propan-2-ylamino]ethyl] ester IUPAC Name: [2-[benzyl(propan-2-yl)amino]-2-oxoethyl] 2-ethylsulfonylbenzoate Traditional Name: 2-esylbenzoic acid [2-[benzyl(isopropyl)amino]-2-keto-ethyl] ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1C(=O)OCC(=O)N(CC2=CC=CC=C2)C(C)C

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1C(=O)OCC(=O)N(CC2=CC=CC=C2)C(C)C

InChI

InChI=1S/C21H25NO5S/c1-4-28(25,26)19-13-9-8-12-18(19)21(24)27-15-20(23)22(16(2)3)14-17-10-6-5-7-11-17/h5-13,16H,4,14-15H2,1-3H3