N-[[4-(aminomethyl)phenyl]methyl]hexatriacontan-18-amine

Systemtic Name: N-[[4-(aminomethyl)phenyl]methyl]hexatriacontan-18-amine Openeye Name: N-[[4-(aminomethyl)phenyl]methyl]hexatriacontan-18-amine CAS Name: N-[[4-(aminomethyl)phenyl]methyl]-18-hexatriacontanamine IUPAC Name: N-[[4-(aminomethyl)phenyl]methyl]hexatriacontan-18-amine Traditional Name: [4-(aminomethyl)benzyl]-(1-heptadecylnonadecyl)amine Formula: C44H84N2 MolecularWeight: 641.15116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCCC)NCC1=CC=C(C=C1)CN

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCCC)NCC1=CC=C(C=C1)CN

InChI

InChI=1S/C44H84N2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-44(46-41-43-38-36-42(40-45)37-39-43)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h36-39,44,46H,3-35,40-41,45H2,1-2H3