ethyl 2-[4-[(4-tert-butylphenyl)sulfonyl-(phenylmethyl)amino]phenyl]ethanoate

Systemtic Name: ethyl 2-[4-[(4-tert-butylphenyl)sulfonyl-(phenylmethyl)amino]phenyl]ethanoate Openeye Name: ethyl 2-[4-[benzyl-(4-tert-butylphenyl)sulfonyl-amino]phenyl]acetate CAS Name: 2-[4-[(4-tert-butylphenyl)sulfonyl-(phenylmethyl)amino]phenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[benzyl-(4-tert-butylphenyl)sulfonylamino]phenyl]acetate Traditional Name: 2-[4-[benzyl-(4-tert-butylphenyl)sulfonyl-amino]phenyl]acetic acid ethyl ester Formula: C27H31NO4S MolecularWeight: 465.60434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC=C(C=C1)N(CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCOC(=O)CC1=CC=C(C=C1)N(CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C27H31NO4S/c1-5-32-26(29)19-21-11-15-24(16-12-21)28(20-22-9-7-6-8-10-22)33(30,31)25-17-13-23(14-18-25)27(2,3)4/h6-18H,5,19-20H2,1-4H3