(3-morpholin-4-ylsulfonylphenyl)methyl 1-methylindole-3-carboxylate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 1-methylindole-3-carboxylate Openeye Name: (3-morpholinosulfonylphenyl)methyl 1-methylindole-3-carboxylate CAS Name: 1-methyl-3-indolecarboxylic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 1-methylindole-3-carboxylate Traditional Name: 1-methylindole-3-carboxylic acid (3-morpholinosulfonylbenzyl) ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C(=O)OCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C(=O)OCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H22N2O5S/c1-22-14-19(18-7-2-3-8-20(18)22)21(24)28-15-16-5-4-6-17(13-16)29(25,26)23-9-11-27-12-10-23/h2-8,13-14H,9-12,15H2,1H3