3-cyanopropyl 5-[(4-ethoxyphenyl)-methyl-sulfamoyl]-2-methyl-benzoate

Systemtic Name: 3-cyanopropyl 5-[(4-ethoxyphenyl)-methyl-sulfamoyl]-2-methyl-benzoate Openeye Name: 3-cyanopropyl 5-[(4-ethoxyphenyl)-methyl-sulfamoyl]-2-methyl-benzoate CAS Name: 5-[(4-ethoxyphenyl)-methylsulfamoyl]-2-methylbenzoic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 5-[(4-ethoxyphenyl)-methylsulfamoyl]-2-methylbenzoate Traditional Name: 2-methyl-5-[methyl(p-phenetyl)sulfamoyl]benzoic acid 3-cyanopropyl ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC(=C(C=C2)C)C(=O)OCCCC#N

Isomeric SMILES

CCOC1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC(=C(C=C2)C)C(=O)OCCCC#N

InChI

InChI=1S/C21H24N2O5S/c1-4-27-18-10-8-17(9-11-18)23(3)29(25,26)19-12-7-16(2)20(15-19)21(24)28-14-6-5-13-22/h7-12,15H,4-6,14H2,1-3H3