2-[[4-[2,5-bis(oxidanylidene)-3,4-diphenyl-pyrrol-1-yl]pyridin-3-yl]methyl]hexanamide

Systemtic Name: 2-[[4-[2,5-bis(oxidanylidene)-3,4-diphenyl-pyrrol-1-yl]pyridin-3-yl]methyl]hexanamide Openeye Name: 2-[[4-(2,5-dioxo-3,4-diphenyl-pyrrol-1-yl)-3-pyridyl]methyl]hexanamide CAS Name: 2-[[4-(2,5-dioxo-3,4-diphenyl-1-pyrrolyl)-3-pyridinyl]methyl]hexanamide IUPAC Name: 2-[[4-(2,5-dioxo-3,4-diphenylpyrrol-1-yl)pyridin-3-yl]methyl]hexanamide Traditional Name: 2-[[4-(2,5-diketo-3,4-diphenyl-3-pyrrolin-1-yl)-3-pyridyl]methyl]hexanamide Formula: C28H27N3O3 MolecularWeight: 453.53228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC1=C(C=CN=C1)N2C(=O)C(=C(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)N

Isomeric SMILES

CCCCC(CC1=C(C=CN=C1)N2C(=O)C(=C(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C28H27N3O3/c1-2-3-10-21(26(29)32)17-22-18-30-16-15-23(22)31-27(33)24(19-11-6-4-7-12-19)25(28(31)34)20-13-8-5-9-14-20/h4-9,11-16,18,21H,2-3,10,17H2,1H3,(H2,29,32)