2-[4-(6-oxidanyl-6-pentadec-14-enyl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidin-1-ium-1-yl)butyl]guanidine

Systemtic Name: 2-[4-(6-oxidanyl-6-pentadec-14-enyl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidin-1-ium-1-yl)butyl]guanidine Openeye Name: 2-[4-(6-hydroxy-6-pentadec-14-enyl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidin-1-ium-1-yl)butyl]guanidine CAS Name: 2-[4-(6-hydroxy-6-pentadec-14-enyl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidin-1-ium-1-yl)butyl]guanidine IUPAC Name: 2-[4-(6-hydroxy-6-pentadec-14-enyl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidin-1-ium-1-yl)butyl]guanidine Traditional Name: 2-[4-(6-hydroxy-6-pentadec-14-enyl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidin-1-ium-1-yl)butyl]guanidine Formula: C27H50N5O+ MolecularWeight: 460.7188

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCCCCCCCCCCC1(C=CC2=[N+](CCCN21)CCCCN=C(N)N)O

Isomeric SMILES

C=CCCCCCCCCCCCCCC1(C=CC2=[N+](CCCN21)CCCCN=C(N)N)O

InChI

InChI=1S/C27H50N5O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-27(33)20-18-25-31(23-17-24-32(25)27)22-16-15-21-30-26(28)29/h2,18,20,33H,1,3-17,19,21-24H2,(H4,28,29,30)/q+1