GDW
Summary
Name: | 5-[2-(diethylamino)ethyl]-7,8-dihydro-6~{H}-indeno[1,2-b]indole-9,10-dione |
Formula: | C21 H24 N2 O2 |
Formal charge: | 0 |
Formula weight: | 336.427 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 5-[2-(diethylamino)ethyl]-7,8-dihydro-6~{H}-indeno[1,2-b]indole-9,10-dione |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C21H24N2O2/c1-3-22(4-2)12-13-23-16-10-7-11-17(24)18(16)19-20(23)14-8-5-6-9-15(14)21(19)25/h5-6,8-9H,3-4,7,10-13H2,1-2H3 |
InChIKey | InChI | 1.03 | YOZDJVVFWHDNEK-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCN(CC)CCn1c2CCCC(=O)c2c3C(=O)c4ccccc4c13 |
SMILES | CACTVS | 3.385 | CCN(CC)CCn1c2CCCC(=O)c2c3C(=O)c4ccccc4c13 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCN(CC)CCn1c2c(c3c1-c4ccccc4C3=O)C(=O)CCC2 |
SMILES | OpenEye OEToolkits | 2.0.6 | CCN(CC)CCn1c2c(c3c1-c4ccccc4C3=O)C(=O)CCC2 |