1-(4-tert-butylphenyl)-N'-hepta-2,4,6-triynyl-methanediamine

Systemtic Name: 1-(4-tert-butylphenyl)-N'-hepta-2,4,6-triynyl-methanediamine Openeye Name: 1-(4-tert-butylphenyl)-N'-hepta-2,4,6-triynyl-methanediamine CAS Name: 1-(4-tert-butylphenyl)-N'-hepta-2,4,6-triynylmethanediamine IUPAC Name: 1-(4-tert-butylphenyl)-N'-hepta-2,4,6-triynylmethanediamine Traditional Name: [amino-(4-tert-butylphenyl)methyl]-hepta-2,4,6-triynyl-amine Formula: C18H20N2 MolecularWeight: 264.3648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(N)NCC#CC#CC#C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(N)NCC#CC#CC#C

InChI

InChI=1S/C18H20N2/c1-5-6-7-8-9-14-20-17(19)15-10-12-16(13-11-15)18(2,3)4/h1,10-13,17,20H,14,19H2,2-4H3