propan-2-yl 2-[(3-chlorophenyl)-[3-(4-phenylmethoxybutanoylamino)phenyl]sulfonyl-amino]ethanoate

Systemtic Name: propan-2-yl 2-[(3-chlorophenyl)-[3-(4-phenylmethoxybutanoylamino)phenyl]sulfonyl-amino]ethanoate Openeye Name: isopropyl 2-(N-[3-(4-benzyloxybutanoylamino)phenyl]sulfonyl-3-chloro-anilino)acetate CAS Name: 2-(3-chloro-N-[3-[(1-oxo-4-phenylmethoxybutyl)amino]phenyl]sulfonylanilino)acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-(3-chloro-N-[3-(4-phenylmethoxybutanoylamino)phenyl]sulfonylanilino)acetate Traditional Name: 2-(N-[3-(4-benzoxybutanoylamino)phenyl]sulfonyl-3-chloro-anilino)acetic acid isopropyl ester Formula: C28H31ClN2O6S MolecularWeight: 559.07354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CN(C1=CC(=CC=C1)Cl)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCCOCC3=CC=CC=C3

Isomeric SMILES

CC(C)OC(=O)CN(C1=CC(=CC=C1)Cl)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCCOCC3=CC=CC=C3

InChI

InChI=1S/C28H31ClN2O6S/c1-21(2)37-28(33)19-31(25-13-6-11-23(29)17-25)38(34,35)26-14-7-12-24(18-26)30-27(32)15-8-16-36-20-22-9-4-3-5-10-22/h3-7,9-14,17-18,21H,8,15-16,19-20H2,1-2H3,(H,30,32)