4-hexyl-N-[2-(4-hexylphenyl)-7-oxidanylidene-benzo[e]perimidin-6-yl]benzamide

Systemtic Name: 4-hexyl-N-[2-(4-hexylphenyl)-7-oxidanylidene-benzo[e]perimidin-6-yl]benzamide Openeye Name: 4-hexyl-N-[2-(4-hexylphenyl)-7-oxo-benzo[e]perimidin-6-yl]benzamide CAS Name: 4-hexyl-N-[2-(4-hexylphenyl)-7-oxo-6-benzo[e]perimidinyl]benzamide IUPAC Name: 4-hexyl-N-[2-(4-hexylphenyl)-7-oxobenzo[e]perimidin-6-yl]benzamide Traditional Name: 4-hexyl-N-[2-(4-hexylphenyl)-7-keto-benzo[e]perimidin-6-yl]benzamide Formula: C40H41N3O2 MolecularWeight: 595.77244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=NC3=C4C(=C(C=C3)NC(=O)C5=CC=C(C=C5)CCCCCC)C(=O)C6=CC=CC=C6C4=N2

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=NC3=C4C(=C(C=C3)NC(=O)C5=CC=C(C=C5)CCCCCC)C(=O)C6=CC=CC=C6C4=N2

InChI

InChI=1S/C40H41N3O2/c1-3-5-7-9-13-27-17-21-29(22-18-27)39-41-33-25-26-34(36-35(33)37(43-39)31-15-11-12-16-32(31)38(36)44)42-40(45)30-23-19-28(20-24-30)14-10-8-6-4-2/h11-12,15-26H,3-10,13-14H2,1-2H3,(H,42,45)