Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Cc1nc2ccccc2c2oc(cc12)C(=O)N1CCCCC1 |
InChI | InChI | 1.03 | InChI=1S/C18H18N2O2/c1-12-14-11-16(18(21)20-9-5-2-6-10-20)22-17(14)13-7-3-4-8-15(13)19-12/h3-4,7-8,11H,2,5-6,9-10H2,1H3 |
InChIKey | InChI | 1.03 | CKBASHMUSIQRHS-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Cc1nc2ccccc2c3oc(cc13)C(=O)N4CCCCC4 |
SMILES | CACTVS | 3.385 | Cc1nc2ccccc2c3oc(cc13)C(=O)N4CCCCC4 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1c2cc(oc2c3ccccc3n1)C(=O)N4CCCCC4 |
SMILES | OpenEye OEToolkits | 2.0.7 | Cc1c2cc(oc2c3ccccc3n1)C(=O)N4CCCCC4 |