ethyl 4-[(4-methoxyphenyl)sulfonyl-phenethyl-amino]butanoate

Systemtic Name: ethyl 4-[(4-methoxyphenyl)sulfonyl-phenethyl-amino]butanoate Openeye Name: ethyl 4-[(4-methoxyphenyl)sulfonyl-phenethyl-amino]butanoate CAS Name: 4-[(4-methoxyphenyl)sulfonyl-phenethylamino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[(4-methoxyphenyl)sulfonyl-phenethylamino]butanoate Traditional Name: 4-[(4-methoxyphenyl)sulfonyl-phenethyl-amino]butyric acid ethyl ester Formula: C21H27NO5S MolecularWeight: 405.50778

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN(CCC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)CCCN(CCC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C21H27NO5S/c1-3-27-21(23)10-7-16-22(17-15-18-8-5-4-6-9-18)28(24,25)20-13-11-19(26-2)12-14-20/h4-6,8-9,11-14H,3,7,10,15-17H2,1-2H3