2-[[3-(acridin-9-ylamino)-5-azanyl-phenyl]methoxy]ethyl 2-azanylpropanoate

Systemtic Name: 2-[[3-(acridin-9-ylamino)-5-azanyl-phenyl]methoxy]ethyl 2-azanylpropanoate Openeye Name: 2-[[3-(acridin-9-ylamino)-5-amino-phenyl]methoxy]ethyl 2-aminopropanoate CAS Name: 2-aminopropanoic acid 2-[[3-(9-acridinylamino)-5-aminophenyl]methoxy]ethyl ester IUPAC Name: 2-[[3-(acridin-9-ylamino)-5-aminophenyl]methoxy]ethyl 2-aminopropanoate Traditional Name: 2-aminopropionic acid 2-[3-(acridin-9-ylamino)-5-amino-benzyl]oxyethyl ester Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCCOCC1=CC(=CC(=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42)N)N

Isomeric SMILES

CC(C(=O)OCCOCC1=CC(=CC(=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42)N)N

InChI

InChI=1S/C25H26N4O3/c1-16(26)25(30)32-11-10-31-15-17-12-18(27)14-19(13-17)28-24-20-6-2-4-8-22(20)29-23-9-5-3-7-21(23)24/h2-9,12-14,16H,10-11,15,26-27H2,1H3,(H,28,29)