(phenylmethyl) 4-chloranyl-2-[[4-methyl-3-(phenylmethoxycarbonylamino)phenyl]sulfonylcarbamoylamino]benzoate

Systemtic Name: (phenylmethyl) 4-chloranyl-2-[[4-methyl-3-(phenylmethoxycarbonylamino)phenyl]sulfonylcarbamoylamino]benzoate Openeye Name: benzyl 2-[[3-(benzyloxycarbonylamino)-4-methyl-phenyl]sulfonylcarbamoylamino]-4-chloro-benzoate CAS Name: 4-chloro-2-[[[[4-methyl-3-(phenylmethoxycarbonylamino)phenyl]sulfonylamino]-oxomethyl]amino]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-chloro-2-[[4-methyl-3-(phenylmethoxycarbonylamino)phenyl]sulfonylcarbamoylamino]benzoate Traditional Name: 2-[[3-(benzyloxycarbonylamino)-4-methyl-phenyl]sulfonylcarbamoylamino]-4-chloro-benzoic acid benzyl ester Formula: C30H26ClN3O7S MolecularWeight: 608.06134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC(=O)NC2=C(C=CC(=C2)Cl)C(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC(=O)NC2=C(C=CC(=C2)Cl)C(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C30H26ClN3O7S/c1-20-12-14-24(17-26(20)33-30(37)41-19-22-10-6-3-7-11-22)42(38,39)34-29(36)32-27-16-23(31)13-15-25(27)28(35)40-18-21-8-4-2-5-9-21/h2-17H,18-19H2,1H3,(H,33,37)(H2,32,34,36)