9UL
Summary
Name: | (3~{Z})-3-(1-methylpyrrolidin-2-ylidene)indole |
Formula: | C13 H14 N2 |
Formal charge: | 0 |
Formula weight: | 198.264 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | (3~{Z})-3-(1-methylpyrrolidin-2-ylidene)indole |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C13H14N2/c1-15-8-4-7-13(15)11-9-14-12-6-3-2-5-10(11)12/h2-3,5-6,9H,4,7-8H2,1H3/b13-11+ |
InChIKey | InChI | 1.03 | HNNADWWHLOZSTI-ACCUITESSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CN\1CCCC\1=C\2C=Nc3ccccc\23 |
SMILES | CACTVS | 3.385 | CN1CCCC1=C2C=Nc3ccccc23 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CN\1CCC/C1=C\2/C=Nc3c2cccc3 |
SMILES | OpenEye OEToolkits | 2.0.6 | CN1CCCC1=C2C=Nc3c2cccc3 |