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2-[4-(acridin-9-ylamino)phenoxy]butanoic acid dihydrate

2-[4-(acridin-9-ylamino)phenoxy]butanoic acid dihydrate

Systemtic Name:2-[4-(acridin-9-ylamino)phenoxy]butanoic acid dihydrate
Openeye Name:2-[4-(acridin-9-ylamino)phenoxy]butanoic acid dihydrate
CAS Name:2-[4-(9-acridinylamino)phenoxy]butanoic acid dihydrate
IUPAC Name:2-[4-(acridin-9-ylamino)phenoxy]butanoic acid dihydrate
Traditional Name:2-[4-(acridin-9-ylamino)phenoxy]butyric acid dihydrate
Formula: C23H24N2O5
MolecularWeight: 408.44706
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)OC1=CC=C(C=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42.O.O


Isomeric SMILES

CCC(C(=O)O)OC1=CC=C(C=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42.O.O


InChI

InChI=1S/C23H20N2O3.2H2O/c1-2-21(23(26)27)28-16-13-11-15(12-14-16)24-22-17-7-3-5-9-19(17)25-20-10-6-4-8-18(20)22;;/h3-14,21H,2H2,1H3,(H,24,25)(H,26,27);2*1H2


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