N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(7H-purin-6-ylamino)propanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(7H-purin-6-ylamino)propanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(7H-purin-6-ylamino)propanamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(7H-purin-6-ylamino)propanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(7H-purin-6-ylamino)propanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(7H-purin-6-ylamino)propionamide Formula: C16H16N6O3 MolecularWeight: 340.33664

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)CCNC3=NC=NC4=C3NC=N4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)CCNC3=NC=NC4=C3NC=N4

InChI

InChI=1S/C16H16N6O3/c23-13(22-10-1-2-11-12(7-10)25-6-5-24-11)3-4-17-15-14-16(19-8-18-14)21-9-20-15/h1-2,7-9H,3-6H2,(H,22,23)(H2,17,18,19,20,21)