(3-morpholin-4-ylsulfonylphenyl)methyl 4-propoxybenzoate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 4-propoxybenzoate Openeye Name: (3-morpholinosulfonylphenyl)methyl 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid (3-morpholinosulfonylbenzyl) ester Formula: C21H25NO6S MolecularWeight: 419.4913

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H25NO6S/c1-2-12-27-19-8-6-18(7-9-19)21(23)28-16-17-4-3-5-20(15-17)29(24,25)22-10-13-26-14-11-22/h3-9,15H,2,10-14,16H2,1H3