3-methyl-7-[(2-methyl-2-piperidin-1-yl-1,3-dioxolan-4-yl)methyl]purine-2,6-dione

Systemtic Name: 3-methyl-7-[(2-methyl-2-piperidin-1-yl-1,3-dioxolan-4-yl)methyl]purine-2,6-dione Openeye Name: 3-methyl-7-[[2-methyl-2-(1-piperidyl)-1,3-dioxolan-4-yl]methyl]purine-2,6-dione CAS Name: 3-methyl-7-[[2-methyl-2-(1-piperidinyl)-1,3-dioxolan-4-yl]methyl]purine-2,6-dione IUPAC Name: 3-methyl-7-[(2-methyl-2-piperidin-1-yl-1,3-dioxolan-4-yl)methyl]purine-2,6-dione Traditional Name: 3-methyl-7-[(2-methyl-2-piperidino-1,3-dioxolan-4-yl)methyl]xanthine Formula: C16H23N5O4 MolecularWeight: 349.38492

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)CN2C=NC3=C2C(=O)NC(=O)N3C)N4CCCCC4

Isomeric SMILES

CC1(OCC(O1)CN2C=NC3=C2C(=O)NC(=O)N3C)N4CCCCC4

InChI

InChI=1S/C16H23N5O4/c1-16(21-6-4-3-5-7-21)24-9-11(25-16)8-20-10-17-13-12(20)14(22)18-15(23)19(13)2/h10-11H,3-9H2,1-2H3,(H,18,22,23)