methyl 4-[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-3-phenylmethoxy-propyl]phenoxy]-3-methylsulfonyl-benzoate

Systemtic Name: methyl 4-[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-3-phenylmethoxy-propyl]phenoxy]-3-methylsulfonyl-benzoate Openeye Name: methyl 4-[4-[3-benzyloxy-2-(tert-butoxycarbonylamino)-3-oxo-propyl]phenoxy]-3-methylsulfonyl-benzoate CAS Name: 4-[4-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxo-3-phenylmethoxypropyl]phenoxy]-3-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 4-[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxo-3-phenylmethoxypropyl]phenoxy]-3-methylsulfonylbenzoate Traditional Name: 4-[4-[3-benzoxy-2-(tert-butoxycarbonylamino)-3-keto-propyl]phenoxy]-3-mesyl-benzoic acid methyl ester Formula: C30H33NO9S MolecularWeight: 583.64932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)OC2=C(C=C(C=C2)C(=O)OC)S(=O)(=O)C)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)OC2=C(C=C(C=C2)C(=O)OC)S(=O)(=O)C)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C30H33NO9S/c1-30(2,3)40-29(34)31-24(28(33)38-19-21-9-7-6-8-10-21)17-20-11-14-23(15-12-20)39-25-16-13-22(27(32)37-4)18-26(25)41(5,35)36/h6-16,18,24H,17,19H2,1-5H3,(H,31,34)