ethyl 4-[[(4-bromophenyl)methyl-(phenylsulfonyl)amino]methyl]benzoate

Systemtic Name: ethyl 4-[[(4-bromophenyl)methyl-(phenylsulfonyl)amino]methyl]benzoate Openeye Name: ethyl 4-[[benzenesulfonyl-[(4-bromophenyl)methyl]amino]methyl]benzoate CAS Name: 4-[[benzenesulfonyl-[(4-bromophenyl)methyl]amino]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[benzenesulfonyl-[(4-bromophenyl)methyl]amino]methyl]benzoate Traditional Name: 4-[[besyl-(4-bromobenzyl)amino]methyl]benzoic acid ethyl ester Formula: C23H22BrNO4S MolecularWeight: 488.39408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CN(CC2=CC=C(C=C2)Br)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CN(CC2=CC=C(C=C2)Br)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H22BrNO4S/c1-2-29-23(26)20-12-8-18(9-13-20)16-25(17-19-10-14-21(24)15-11-19)30(27,28)22-6-4-3-5-7-22/h3-15H,2,16-17H2,1H3