N-heptyl-4-[[4-(heptylamino)phenyl]methyl]aniline dihydrochloride

Systemtic Name: N-heptyl-4-[[4-(heptylamino)phenyl]methyl]aniline dihydrochloride Openeye Name: N-heptyl-4-[[4-(heptylamino)phenyl]methyl]aniline dihydrochloride CAS Name: N-heptyl-4-[[4-(heptylamino)phenyl]methyl]aniline dihydrochloride IUPAC Name: N-heptyl-4-[[4-(heptylamino)phenyl]methyl]aniline dihydrochloride Traditional Name: heptyl-[4-[4-(heptylamino)benzyl]phenyl]amine dihydrochloride Formula: C27H44Cl2N2 MolecularWeight: 467.55766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC1=CC=C(C=C1)CC2=CC=C(C=C2)NCCCCCCC.Cl.Cl

Isomeric SMILES

CCCCCCCNC1=CC=C(C=C1)CC2=CC=C(C=C2)NCCCCCCC.Cl.Cl

InChI

InChI=1S/C27H42N2.2ClH/c1-3-5-7-9-11-21-28-26-17-13-24(14-18-26)23-25-15-19-27(20-16-25)29-22-12-10-8-6-4-2;;/h13-20,28-29H,3-12,21-23H2,1-2H3;2*1H