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

Systemtic Name: ethyl 3-[(4-butylphenyl)sulfonyl-(phenylmethyl)amino]propanoate Openeye Name: ethyl 3-[benzyl-(4-butylphenyl)sulfonyl-amino]propanoate CAS Name: 3-[(4-butylphenyl)sulfonyl-(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[benzyl-(4-butylphenyl)sulfonylamino]propanoate Traditional Name: 3-[benzyl-(4-butylphenyl)sulfonyl-amino]propionic acid ethyl ester Formula: C22H29NO4S MolecularWeight: 403.53496

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)OCC)CC2=CC=CC=C2

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)OCC)CC2=CC=CC=C2

InChI

InChI=1S/C22H29NO4S/c1-3-5-9-19-12-14-21(15-13-19)28(25,26)23(17-16-22(24)27-4-2)18-20-10-7-6-8-11-20/h6-8,10-15H,3-5,9,16-18H2,1-2H3