ethyl 1-[3-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]propyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[3-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]propyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[3-(3,7-dimethyl-2,6-dioxo-purin-1-yl)propyl]piperidine-3-carboxylate CAS Name: 1-[3-(3,7-dimethyl-2,6-dioxo-1-purinyl)propyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(3,7-dimethyl-2,6-dioxopurin-1-yl)propyl]piperidine-3-carboxylate Traditional Name: 1-[3-(2,6-diketo-3,7-dimethyl-purin-1-yl)propyl]nipecotic acid ethyl ester Formula: C18H27N5O4 MolecularWeight: 377.43808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CCCN2C(=O)C3=C(N=CN3C)N(C2=O)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)CCCN2C(=O)C3=C(N=CN3C)N(C2=O)C

InChI

InChI=1S/C18H27N5O4/c1-4-27-17(25)13-7-5-8-22(11-13)9-6-10-23-16(24)14-15(19-12-20(14)2)21(3)18(23)26/h12-13H,4-11H2,1-3H3