ethyl 2-[[3-(acridin-9-ylamino)-5-(hydroxymethyl)phenyl]amino]propanoate

Systemtic Name: ethyl 2-[[3-(acridin-9-ylamino)-5-(hydroxymethyl)phenyl]amino]propanoate Openeye Name: ethyl 2-[3-(acridin-9-ylamino)-5-(hydroxymethyl)anilino]propanoate CAS Name: 2-[3-(9-acridinylamino)-5-(hydroxymethyl)anilino]propanoic acid ethyl ester IUPAC Name: ethyl 2-[3-(acridin-9-ylamino)-5-(hydroxymethyl)anilino]propanoate Traditional Name: 2-[3-(acridin-9-ylamino)-5-methylol-anilino]propionic acid ethyl ester Formula: C25H25N3O3 MolecularWeight: 415.4843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25N3O3/c1-3-31-25(30)16(2)26-18-12-17(15-29)13-19(14-18)27-24-20-8-4-6-10-22(20)28-23-11-7-5-9-21(23)24/h4-14,16,26,29H,3,15H2,1-2H3,(H,27,28)