N-dodecyl-4-[5-(4-isocyanophenyl)-3,4-dihydropyrazol-2-yl]aniline

Systemtic Name: N-dodecyl-4-[5-(4-isocyanophenyl)-3,4-dihydropyrazol-2-yl]aniline Openeye Name: N-dodecyl-4-[5-(4-isocyanophenyl)-3,4-dihydropyrazol-2-yl]aniline CAS Name: N-dodecyl-4-[5-(4-isocyanophenyl)-3,4-dihydropyrazol-2-yl]aniline IUPAC Name: N-dodecyl-4-[5-(4-isocyanophenyl)-3,4-dihydropyrazol-2-yl]aniline Traditional Name: [4-[3-(4-isocyanophenyl)-2-pyrazolin-1-yl]phenyl]-lauryl-amine Formula: C28H38N4 MolecularWeight: 430.62812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC1=CC=C(C=C1)N2CCC(=N2)C3=CC=C(C=C3)[N+]#[C-]

Isomeric SMILES

CCCCCCCCCCCCNC1=CC=C(C=C1)N2CCC(=N2)C3=CC=C(C=C3)[N+]#[C-]

InChI

InChI=1S/C28H38N4/c1-3-4-5-6-7-8-9-10-11-12-22-30-26-17-19-27(20-18-26)32-23-21-28(31-32)24-13-15-25(29-2)16-14-24/h13-20,30H,3-12,21-23H2,1H3