N,N'-bis[(5S)-2-phenylmethoxy-5,6,7,8-tetrahydroquinolin-5-yl]dodecane-1,12-diamine

Systemtic Name: N,N'-bis[(5S)-2-phenylmethoxy-5,6,7,8-tetrahydroquinolin-5-yl]dodecane-1,12-diamine Openeye Name: N,N'-bis[(5S)-2-benzyloxy-5,6,7,8-tetrahydroquinolin-5-yl]dodecane-1,12-diamine CAS Name: N,N'-bis[(5S)-2-phenylmethoxy-5,6,7,8-tetrahydroquinolin-5-yl]dodecane-1,12-diamine IUPAC Name: N,N'-bis[(5S)-2-phenylmethoxy-5,6,7,8-tetrahydroquinolin-5-yl]dodecane-1,12-diamine Traditional Name: [(5S)-2-benzoxy-5,6,7,8-tetrahydroquinolin-5-yl]-[12-[[(5S)-2-benzoxy-5,6,7,8-tetrahydroquinolin-5-yl]amino]dodecyl]amine Formula: C44H58N4O2 MolecularWeight: 674.95692

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)N=C(C=C2)OCC3=CC=CC=C3)NCCCCCCCCCCCCNC4CCCC5=C4C=CC(=N5)OCC6=CC=CC=C6

Isomeric SMILES

C1C[C@@H](C2=C(C1)N=C(C=C2)OCC3=CC=CC=C3)NCCCCCCCCCCCCN[C@H]4CCCC5=C4C=CC(=N5)OCC6=CC=CC=C6

InChI

InChI=1S/C44H58N4O2/c1(3-5-7-15-31-45-39-23-17-25-41-37(39)27-29-43(47-41)49-33-35-19-11-9-12-20-35)2-4-6-8-16-32-46-40-24-18-26-42-38(40)28-30-44(48-42)50-34-36-21-13-10-14-22-36/h9-14,19-22,27-30,39-40,45-46H,1-8,15-18,23-26,31-34H2/t39-,40-/m0/s1