(phenylmethyl) 2-[2,3-dihydro-1H-indol-2-ylcarbonyl-(4-methylphenyl)sulfonyl-amino]-3-phenyl-propanoate

Systemtic Name: (phenylmethyl) 2-[2,3-dihydro-1H-indol-2-ylcarbonyl-(4-methylphenyl)sulfonyl-amino]-3-phenyl-propanoate Openeye Name: benzyl 2-[indoline-2-carbonyl(p-tolylsulfonyl)amino]-3-phenyl-propanoate CAS Name: 2-[[2,3-dihydro-1H-indol-2-yl(oxo)methyl]-(4-methylphenyl)sulfonylamino]-3-phenylpropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2,3-dihydro-1H-indole-2-carbonyl-(4-methylphenyl)sulfonylamino]-3-phenylpropanoate Traditional Name: 2-[indoline-2-carbonyl(tosyl)amino]-3-phenyl-propionic acid benzyl ester Formula: C32H30N2O5S MolecularWeight: 554.656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)C(=O)C4CC5=CC=CC=C5N4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)C(=O)C4CC5=CC=CC=C5N4

InChI

InChI=1S/C32H30N2O5S/c1-23-16-18-27(19-17-23)40(37,38)34(31(35)29-21-26-14-8-9-15-28(26)33-29)30(20-24-10-4-2-5-11-24)32(36)39-22-25-12-6-3-7-13-25/h2-19,29-30,33H,20-22H2,1H3