3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(2-phenoxyethyl)propanamide

Systemtic Name: 3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(2-phenoxyethyl)propanamide Openeye Name: 3-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(2-phenoxyethyl)propanamide CAS Name: 3-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-(2-phenoxyethyl)propanamide IUPAC Name: 3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(2-phenoxyethyl)propanamide Traditional Name: 3-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(2-phenoxyethyl)propionamide Formula: C18H21N5O4 MolecularWeight: 371.39044

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCC(=O)NCCOC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCC(=O)NCCOC3=CC=CC=C3

InChI

InChI=1S/C18H21N5O4/c1-21-16-15(17(25)22(2)18(21)26)23(12-20-16)10-8-14(24)19-9-11-27-13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3,(H,19,24)