MVJ
Summary
Name: | 5-cyclohexylspiro[1H-indole-3,4'-oxane]-2-one |
Formula: | C18 H23 N O2 |
Formal charge: | 0 |
Formula weight: | 285.381 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 1.7.6 | 5-cyclohexylspiro[1H-indole-3,4'-oxane]-2-one |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C18H23NO2/c20-17-18(8-10-21-11-9-18)15-12-14(6-7-16(15)19-17)13-4-2-1-3-5-13/h6-7,12-13H,1-5,8-11H2,(H,19,20) |
InChIKey | InChI | 1.03 | RZFQOJSXHMJDFD-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | O=C1Nc2ccc(cc2C13CCOCC3)C4CCCCC4 |
SMILES | CACTVS | 3.385 | O=C1Nc2ccc(cc2C13CCOCC3)C4CCCCC4 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc2c(cc1C3CCCCC3)C4(CCOCC4)C(=O)N2 |
SMILES | OpenEye OEToolkits | 1.7.6 | c1cc2c(cc1C3CCCCC3)C4(CCOCC4)C(=O)N2 |