[4-tert-butyl-7-[2-chloranyl-4-(3-phenylmethoxyphenyl)sulfanyl-phenyl]-2-ethoxycarbonyl-2,3-dimethyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]heptoxy]silicon

Systemtic Name: [4-tert-butyl-7-[2-chloranyl-4-(3-phenylmethoxyphenyl)sulfanyl-phenyl]-2-ethoxycarbonyl-2,3-dimethyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]heptoxy]silicon Openeye Name: [7-[4-(3-benzyloxyphenyl)sulfanyl-2-chloro-phenyl]-4-(tert-butoxycarbonylamino)-4-tert-butyl-2-ethoxycarbonyl-2,3-dimethyl-heptoxy]silicon CAS Name: [4-tert-butyl-7-[2-chloro-4-[(3-phenylmethoxyphenyl)thio]phenyl]-2-ethoxycarbonyl-2,3-dimethyl-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]heptoxy]silicon IUPAC Name: [4-tert-butyl-7-[2-chloro-4-(3-phenylmethoxyphenyl)sulfanylphenyl]-2-ethoxycarbonyl-2,3-dimethyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]heptoxy]silicon Traditional Name: [7-[4-[(3-benzoxyphenyl)thio]-2-chloro-phenyl]-4-(tert-butoxycarbonylamino)-4-tert-butyl-2-carbethoxy-2,3-dimethyl-heptoxy]silicon Formula: C40H53ClNO6SSi MolecularWeight: 739.45542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(CO[Si])C(C)C(CCCC1=C(C=C(C=C1)SC2=CC=CC(=C2)OCC3=CC=CC=C3)Cl)(C(C)(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(C)(CO[Si])C(C)C(CCCC1=C(C=C(C=C1)SC2=CC=CC(=C2)OCC3=CC=CC=C3)Cl)(C(C)(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C40H53ClNO6SSi/c1-10-45-35(43)39(9,27-47-50)28(2)40(37(3,4)5,42-36(44)48-38(6,7)8)23-15-18-30-21-22-33(25-34(30)41)49-32-20-14-19-31(24-32)46-26-29-16-12-11-13-17-29/h11-14,16-17,19-22,24-25,28H,10,15,18,23,26-27H2,1-9H3,(H,42,44)