(phenylmethyl) N-[4-oxidanylidene-4-[[4-[2,3,6-triphenyl-5-[4-[tris(4-ethynylphenyl)methyl]phenyl]phenyl]phenyl]amino]butyl]carbamate

Systemtic Name: (phenylmethyl) N-[4-oxidanylidene-4-[[4-[2,3,6-triphenyl-5-[4-[tris(4-ethynylphenyl)methyl]phenyl]phenyl]phenyl]amino]butyl]carbamate Openeye Name: benzyl N-[4-oxo-4-[4-[2,3,6-triphenyl-5-[4-[tris(4-ethynylphenyl)methyl]phenyl]phenyl]anilino]butyl]carbamate CAS Name: N-[4-oxo-4-[4-[2,3,6-triphenyl-5-[4-[tris(4-ethynylphenyl)methyl]phenyl]phenyl]anilino]butyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[4-oxo-4-[4-[2,3,6-triphenyl-5-[4-[tris(4-ethynylphenyl)methyl]phenyl]phenyl]anilino]butyl]carbamate Traditional Name: N-[4-keto-4-[4-[2,3,6-triphenyl-5-[4-[tris(4-ethynylphenyl)methyl]phenyl]phenyl]anilino]butyl]carbamic acid benzyl ester Formula: C73H54N2O3 MolecularWeight: 1007.22146

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC=C(C=C1)C(C2=CC=C(C=C2)C#C)(C3=CC=C(C=C3)C#C)C4=CC=C(C=C4)C5=C(C(=C(C(=C5)C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=C(C=C8)NC(=O)CCCNC(=O)OCC9=CC=CC=C9)C1=CC=CC=C1

Isomeric SMILES

C#CC1=CC=C(C=C1)C(C2=CC=C(C=C2)C#C)(C3=CC=C(C=C3)C#C)C4=CC=C(C=C4)C5=C(C(=C(C(=C5)C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=C(C=C8)NC(=O)CCCNC(=O)OCC9=CC=CC=C9)C1=CC=CC=C1

InChI

InChI=1S/C73H54N2O3/c1-4-52-29-39-61(40-30-52)73(62-41-31-53(5-2)32-42-62,63-43-33-54(6-3)34-44-63)64-45-35-57(36-46-64)67-50-66(56-22-13-8-14-23-56)69(58-24-15-9-16-25-58)71(70(67)59-26-17-10-18-27-59)60-37-47-65(48-38-60)75-68(76)28-19-49-74-72(77)78-51-55-20-11-7-12-21-55/h1-3,7-18,20-27,29-48,50H,19,28,49,51H2,(H,74,77)(H,75,76)