N-[3-(acridin-9-ylamino)-5-(hydroxymethyl)-2-(4-oxidanylidenepentanoyl)phenyl]-4-oxidanylidene-pentanamide

Systemtic Name: N-[3-(acridin-9-ylamino)-5-(hydroxymethyl)-2-(4-oxidanylidenepentanoyl)phenyl]-4-oxidanylidene-pentanamide Openeye Name: N-[3-(acridin-9-ylamino)-5-(hydroxymethyl)-2-(4-oxopentanoyl)phenyl]-4-oxo-pentanamide CAS Name: N-[3-(9-acridinylamino)-2-(1,4-dioxopentyl)-5-(hydroxymethyl)phenyl]-4-oxopentanamide IUPAC Name: N-[3-(acridin-9-ylamino)-5-(hydroxymethyl)-2-(4-oxopentanoyl)phenyl]-4-oxopentanamide Traditional Name: N-[3-(acridin-9-ylamino)-2-(4-ketopentanoyl)-5-methylol-phenyl]-4-keto-valeramide Formula: C30H29N3O5 MolecularWeight: 511.56836

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(=O)C1=C(C=C(C=C1NC(=O)CCC(=O)C)CO)NC2=C3C=CC=CC3=NC4=CC=CC=C42

Isomeric SMILES

CC(=O)CCC(=O)C1=C(C=C(C=C1NC(=O)CCC(=O)C)CO)NC2=C3C=CC=CC3=NC4=CC=CC=C42

InChI

InChI=1S/C30H29N3O5/c1-18(35)11-13-27(37)29-25(32-28(38)14-12-19(2)36)15-20(17-34)16-26(29)33-30-21-7-3-5-9-23(21)31-24-10-6-4-8-22(24)30/h3-10,15-16,34H,11-14,17H2,1-2H3,(H,31,33)(H,32,38)