Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c1cc(ccc1c2nccn2)OCCCCCCCOc3ccc(cc3)c4nccn4 |
InChI | InChI | 1.03 | InChI=1S/C25H28N4O2/c1(2-4-18-30-22-10-6-20(7-11-22)24-26-14-15-27-24)3-5-19-31-23-12-8-21(9-13-23)25-28-16-17-29-25/h6-17H,1-5,18-19H2,(H,26,27)(H,28,29) |
InChIKey | InChI | 1.03 | LGLZBONOWHSGOF-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | C(CCCOc1ccc(cc1)c2[nH]ccn2)CCCOc3ccc(cc3)c4[nH]ccn4 |
SMILES | CACTVS | 3.385 | C(CCCOc1ccc(cc1)c2[nH]ccn2)CCCOc3ccc(cc3)c4[nH]ccn4 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1cc(ccc1c2[nH]ccn2)OCCCCCCCOc3ccc(cc3)c4[nH]ccn4 |
SMILES | OpenEye OEToolkits | 1.9.2 | c1cc(ccc1c2[nH]ccn2)OCCCCCCCOc3ccc(cc3)c4[nH]ccn4 |