9-[[3-(hydroxymethyl)-5-(propoxycarbonylamino)phenyl]amino]acridine-3-carboxylic acid

Systemtic Name: 9-[[3-(hydroxymethyl)-5-(propoxycarbonylamino)phenyl]amino]acridine-3-carboxylic acid Openeye Name: 9-[3-(hydroxymethyl)-5-(propoxycarbonylamino)anilino]acridine-3-carboxylic acid CAS Name: 9-[3-(hydroxymethyl)-5-[[oxo(propoxy)methyl]amino]anilino]-3-acridinecarboxylic acid IUPAC Name: 9-[3-(hydroxymethyl)-5-(propoxycarbonylamino)anilino]acridine-3-carboxylic acid Traditional Name: 9-[3-methylol-5-(propoxycarbonylamino)anilino]acridine-3-carboxylic acid Formula: C25H23N3O5 MolecularWeight: 445.46722

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)NC1=CC(=CC(=C1)NC2=C3C=CC(=CC3=NC4=CC=CC=C42)C(=O)O)CO

Isomeric SMILES

CCCOC(=O)NC1=CC(=CC(=C1)NC2=C3C=CC(=CC3=NC4=CC=CC=C42)C(=O)O)CO

InChI

InChI=1S/C25H23N3O5/c1-2-9-33-25(32)27-18-11-15(14-29)10-17(13-18)26-23-19-5-3-4-6-21(19)28-22-12-16(24(30)31)7-8-20(22)23/h3-8,10-13,29H,2,9,14H2,1H3,(H,26,28)(H,27,32)(H,30,31)