1-[(Z)-3-chloranylbut-2-enyl]-3,7-dimethyl-8-piperidin-1-yl-4,5-dihydropurine-2,6-dione

Systemtic Name: 1-[(Z)-3-chloranylbut-2-enyl]-3,7-dimethyl-8-piperidin-1-yl-4,5-dihydropurine-2,6-dione Openeye Name: 1-[(Z)-3-chlorobut-2-enyl]-3,7-dimethyl-8-(1-piperidyl)-4,5-dihydropurine-2,6-dione CAS Name: 1-[(Z)-3-chlorobut-2-enyl]-3,7-dimethyl-8-(1-piperidinyl)-4,5-dihydropurine-2,6-dione IUPAC Name: 1-[(Z)-3-chlorobut-2-enyl]-3,7-dimethyl-8-piperidin-1-yl-4,5-dihydropurine-2,6-dione Traditional Name: 1-[(Z)-3-chlorobut-2-enyl]-3,7-dimethyl-8-piperidino-4,5-dihydropurine-2,6-quinone Formula: C16H24ClN5O2 MolecularWeight: 353.84706

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1C(=O)C2C(N=C(N2C)N3CCCCC3)N(C1=O)C)Cl

Isomeric SMILES

C/C(=C/CN1C(=O)C2C(N=C(N2C)N3CCCCC3)N(C1=O)C)/Cl

InChI

InChI=1S/C16H24ClN5O2/c1-11(17)7-10-22-14(23)12-13(20(3)16(22)24)18-15(19(12)2)21-8-5-4-6-9-21/h7,12-13H,4-6,8-10H2,1-3H3/b11-7-