2-azanyl-9-[(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoyl]-3H-purin-6-one Openeye Name: 2-amino-9-[(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoyl]-3H-purin-6-one CAS Name: 2-amino-9-[(2E,4E,6E,8E)-3,7-dimethyl-1-oxo-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoyl]-3H-purin-6-one Traditional Name: 2-amino-9-[(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoyl]-3H-purin-6-one Formula: C25H31N5O2 MolecularWeight: 433.54594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC(=O)N2C=NC3=C2NC(=NC3=O)N)C)C

Isomeric SMILES

CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C(=O)N2C=NC3=C2NC(=NC3=O)N)/C)/C

InChI

InChI=1S/C25H31N5O2/c1-16(11-12-19-18(3)10-7-13-25(19,4)5)8-6-9-17(2)14-20(31)30-15-27-21-22(30)28-24(26)29-23(21)32/h6,8-9,11-12,14-15H,7,10,13H2,1-5H3,(H3,26,28,29,32)/b9-6+,12-11+,16-8+,17-14+