3-pyridin-4-ylpropyl 2-methyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: 3-pyridin-4-ylpropyl 2-methyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: 3-(4-pyridyl)propyl 2-methyl-5-morpholinosulfonyl-benzoate CAS Name: 2-methyl-5-(4-morpholinylsulfonyl)benzoic acid 3-pyridin-4-ylpropyl ester IUPAC Name: 3-pyridin-4-ylpropyl 2-methyl-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-methyl-5-morpholinosulfonyl-benzoic acid 3-(4-pyridyl)propyl ester Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OCCCC3=CC=NC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OCCCC3=CC=NC=C3

InChI

InChI=1S/C20H24N2O5S/c1-16-4-5-18(28(24,25)22-10-13-26-14-11-22)15-19(16)20(23)27-12-2-3-17-6-8-21-9-7-17/h4-9,15H,2-3,10-14H2,1H3