1-[2-[2-(1-adamantyl)-5-phenyl-pyrrol-1-yl]ethyl]-2-(3-oxidanylpropyl)guanidine

Systemtic Name: 1-[2-[2-(1-adamantyl)-5-phenyl-pyrrol-1-yl]ethyl]-2-(3-oxidanylpropyl)guanidine Openeye Name: 1-[2-[2-(1-adamantyl)-5-phenyl-pyrrol-1-yl]ethyl]-2-(3-hydroxypropyl)guanidine CAS Name: 1-[2-[2-(1-adamantyl)-5-phenyl-1-pyrrolyl]ethyl]-2-(3-hydroxypropyl)guanidine IUPAC Name: 1-[2-[2-(1-adamantyl)-5-phenylpyrrol-1-yl]ethyl]-2-(3-hydroxypropyl)guanidine Traditional Name: 1-[2-[2-(1-adamantyl)-5-phenyl-pyrrol-1-yl]ethyl]-2-(3-hydroxypropyl)guanidine Formula: C26H36N4O MolecularWeight: 420.59024

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC=C(N4CCNC(=NCCCO)N)C5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=C(N4CCNC(=NCCCO)N)C5=CC=CC=C5

InChI

InChI=1S/C26H36N4O/c27-25(28-9-4-12-31)29-10-11-30-23(22-5-2-1-3-6-22)7-8-24(30)26-16-19-13-20(17-26)15-21(14-19)18-26/h1-3,5-8,19-21,31H,4,9-18H2,(H3,27,28,29)