ethyl 3-[(phenylmethyl)-(4-propylphenyl)sulfonyl-amino]propanoate

Systemtic Name: ethyl 3-[(phenylmethyl)-(4-propylphenyl)sulfonyl-amino]propanoate Openeye Name: ethyl 3-[benzyl-(4-propylphenyl)sulfonyl-amino]propanoate CAS Name: 3-[(phenylmethyl)-(4-propylphenyl)sulfonylamino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[benzyl-(4-propylphenyl)sulfonylamino]propanoate Traditional Name: 3-[benzyl-(4-propylphenyl)sulfonyl-amino]propionic acid ethyl ester Formula: C21H27NO4S MolecularWeight: 389.50838

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)OCC)CC2=CC=CC=C2

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)OCC)CC2=CC=CC=C2

InChI

InChI=1S/C21H27NO4S/c1-3-8-18-11-13-20(14-12-18)27(24,25)22(16-15-21(23)26-4-2)17-19-9-6-5-7-10-19/h5-7,9-14H,3-4,8,15-17H2,1-2H3