N-methyl-N-(6-oxidanylhexyl)-2-(3-phenylazanyl-6-phenylimino-xanthen-9-yl)benzamide

Systemtic Name: N-methyl-N-(6-oxidanylhexyl)-2-(3-phenylazanyl-6-phenylimino-xanthen-9-yl)benzamide Openeye Name: 2-(3-anilino-6-phenylimino-xanthen-9-yl)-N-(6-hydroxyhexyl)-N-methyl-benzamide CAS Name: 2-(3-anilino-6-phenylimino-9-xanthenyl)-N-(6-hydroxyhexyl)-N-methylbenzamide IUPAC Name: 2-(3-anilino-6-phenyliminoxanthen-9-yl)-N-(6-hydroxyhexyl)-N-methylbenzamide Traditional Name: 2-(3-anilino-6-phenylimino-xanthen-9-yl)-N-(6-hydroxyhexyl)-N-methyl-benzamide Formula: C39H37N3O3 MolecularWeight: 595.72938

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCCCO)C(=O)C1=CC=CC=C1C2=C3C=CC(=NC4=CC=CC=C4)C=C3OC5=C2C=CC(=C5)NC6=CC=CC=C6

Isomeric SMILES

CN(CCCCCCO)C(=O)C1=CC=CC=C1C2=C3C=CC(=NC4=CC=CC=C4)C=C3OC5=C2C=CC(=C5)NC6=CC=CC=C6

InChI

InChI=1S/C39H37N3O3/c1-42(24-12-2-3-13-25-43)39(44)33-19-11-10-18-32(33)38-34-22-20-30(40-28-14-6-4-7-15-28)26-36(34)45-37-27-31(21-23-35(37)38)41-29-16-8-5-9-17-29/h4-11,14-23,26-27,40,43H,2-3,12-13,24-25H2,1H3