6-[[2-(2-chlorophenyl)-5-(4-hexoxyphenyl)pyrrol-1-yl]methyl]pyridin-2-amine

Systemtic Name: 6-[[2-(2-chlorophenyl)-5-(4-hexoxyphenyl)pyrrol-1-yl]methyl]pyridin-2-amine Openeye Name: 6-[[2-(2-chlorophenyl)-5-(4-hexoxyphenyl)pyrrol-1-yl]methyl]pyridin-2-amine CAS Name: 6-[[2-(2-chlorophenyl)-5-(4-hexoxyphenyl)-1-pyrrolyl]methyl]-2-pyridinamine IUPAC Name: 6-[[2-(2-chlorophenyl)-5-(4-hexoxyphenyl)pyrrol-1-yl]methyl]pyridin-2-amine Traditional Name: [6-[[2-(2-chlorophenyl)-5-(4-hexoxyphenyl)pyrrol-1-yl]methyl]-2-pyridyl]amine Formula: C28H30ClN3O MolecularWeight: 460.0103

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2=CC=C(N2CC3=NC(=CC=C3)N)C4=CC=CC=C4Cl

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2=CC=C(N2CC3=NC(=CC=C3)N)C4=CC=CC=C4Cl

InChI

InChI=1S/C28H30ClN3O/c1-2-3-4-7-19-33-23-15-13-21(14-16-23)26-17-18-27(24-10-5-6-11-25(24)29)32(26)20-22-9-8-12-28(30)31-22/h5-6,8-18H,2-4,7,19-20H2,1H3,(H2,30,31)