2-methyl-1-[2,2,3-tris(2-nonylphenyl)-3-[(2-nonylphenyl)methyl]aziridin-1-yl]cyclopropane-1-carbaldehyde

Systemtic Name: 2-methyl-1-[2,2,3-tris(2-nonylphenyl)-3-[(2-nonylphenyl)methyl]aziridin-1-yl]cyclopropane-1-carbaldehyde Openeye Name: 2-methyl-1-[2,2,3-tris(2-nonylphenyl)-3-[(2-nonylphenyl)methyl]aziridin-1-yl]cyclopropanecarbaldehyde CAS Name: 2-methyl-1-[2,2,3-tris(2-nonylphenyl)-3-[(2-nonylphenyl)methyl]-1-aziridinyl]-1-cyclopropanecarboxaldehyde IUPAC Name: 2-methyl-1-[2,2,3-tris(2-nonylphenyl)-3-[(2-nonylphenyl)methyl]aziridin-1-yl]cyclopropane-1-carbaldehyde Traditional Name: 2-methyl-1-[2-(2-nonylbenzyl)-2,3,3-tris(2-nonylphenyl)ethylenimin-1-yl]cyclopropanecarbaldehyde Formula: C68H101NO MolecularWeight: 948.53564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=CC=C1CC2(C(N2C3(CC3C)C=O)(C4=CC=CC=C4CCCCCCCCC)C5=CC=CC=C5CCCCCCCCC)C6=CC=CC=C6CCCCCCCCC

Isomeric SMILES

CCCCCCCCCC1=CC=CC=C1CC2(C(N2C3(CC3C)C=O)(C4=CC=CC=C4CCCCCCCCC)C5=CC=CC=C5CCCCCCCCC)C6=CC=CC=C6CCCCCCCCC

InChI

InChI=1S/C68H101NO/c1-6-10-14-18-22-26-30-42-58-43-34-35-50-62(58)55-67(63-51-39-36-47-59(63)44-31-27-23-19-15-11-7-2)68(69(67)66(56-70)54-57(66)5,64-52-40-37-48-60(64)45-32-28-24-20-16-12-8-3)65-53-41-38-49-61(65)46-33-29-25-21-17-13-9-4/h34-41,43,47-53,56-57H,6-33,42,44-46,54-55H2,1-5H3