butyl 4-[[4,5-dimethoxy-2-[methylsulfonyl-(phenylmethyl)amino]phenyl]carbonylamino]benzoate

Systemtic Name: butyl 4-[[4,5-dimethoxy-2-[methylsulfonyl-(phenylmethyl)amino]phenyl]carbonylamino]benzoate Openeye Name: butyl 4-[[2-[benzyl(methylsulfonyl)amino]-4,5-dimethoxy-benzoyl]amino]benzoate CAS Name: 4-[[[4,5-dimethoxy-2-[methylsulfonyl-(phenylmethyl)amino]phenyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[benzyl(methylsulfonyl)amino]-4,5-dimethoxybenzoyl]amino]benzoate Traditional Name: 4-[[2-[benzyl(mesyl)amino]-4,5-dimethoxy-benzoyl]amino]benzoic acid butyl ester Formula: C28H32N2O7S MolecularWeight: 540.62788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2N(CC3=CC=CC=C3)S(=O)(=O)C)OC)OC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2N(CC3=CC=CC=C3)S(=O)(=O)C)OC)OC

InChI

InChI=1S/C28H32N2O7S/c1-5-6-16-37-28(32)21-12-14-22(15-13-21)29-27(31)23-17-25(35-2)26(36-3)18-24(23)30(38(4,33)34)19-20-10-8-7-9-11-20/h7-15,17-18H,5-6,16,19H2,1-4H3,(H,29,31)