11-(octadecylamino)-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile

Systemtic Name: 11-(octadecylamino)-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile Openeye Name: 11-(octadecylamino)-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile CAS Name: 11-(octadecylamino)-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile IUPAC Name: 11-(octadecylamino)-7,8,9,10-tetrahydrobenzimidazolo[1,2-b]isoquinoline-6-carbonitrile Traditional Name: 11-(stearylamino)-7,8,9,10-tetrahydrobenzimidazol[1,2-b]isoquinoline-6-carbonitrile Formula: C34H50N4 MolecularWeight: 514.7876

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC1=C2CCCCC2=C(C3=NC4=CC=CC=C4N13)C#N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC1=C2CCCCC2=C(C3=NC4=CC=CC=C4N13)C#N

InChI

InChI=1S/C34H50N4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-26-36-33-29-23-18-17-22-28(29)30(27-35)34-37-31-24-19-20-25-32(31)38(33)34/h19-20,24-25,36H,2-18,21-23,26H2,1H3