tert-butyl 4-[2-[(4-chlorophenyl)sulfonylamino]ethoxymethyl]-7-pyridin-3-yl-heptanoate

Systemtic Name: tert-butyl 4-[2-[(4-chlorophenyl)sulfonylamino]ethoxymethyl]-7-pyridin-3-yl-heptanoate Openeye Name: tert-butyl 4-[2-[(4-chlorophenyl)sulfonylamino]ethoxymethyl]-7-(3-pyridyl)heptanoate CAS Name: 4-[2-[(4-chlorophenyl)sulfonylamino]ethoxymethyl]-7-(3-pyridinyl)heptanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[(4-chlorophenyl)sulfonylamino]ethoxymethyl]-7-pyridin-3-ylheptanoate Traditional Name: 4-[2-[(4-chlorophenyl)sulfonylamino]ethoxymethyl]-7-(3-pyridyl)enanthic acid tert-butyl ester Formula: C25H35ClN2O5S MolecularWeight: 511.0738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC(CCCC1=CN=CC=C1)COCCNS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)CCC(CCCC1=CN=CC=C1)COCCNS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C25H35ClN2O5S/c1-25(2,3)33-24(29)14-9-21(7-4-6-20-8-5-15-27-18-20)19-32-17-16-28-34(30,31)23-12-10-22(26)11-13-23/h5,8,10-13,15,18,21,28H,4,6-7,9,14,16-17,19H2,1-3H3