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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

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