S0I
Summary
| Name: | 4-benzyl-3,4-dihydroquinoxalin-2(1H)-one |
| Formula: | C15 H14 N2 O |
| Formal charge: | 0 |
| Formula weight: | 238.284 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-benzyl-3,4-dihydroquinoxalin-2(1H)-one |
| OpenEye OEToolkits | 1.7.6 | 4-(phenylmethyl)-1,3-dihydroquinoxalin-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C2Nc1c(cccc1)N(C2)Cc3ccccc3 |
| InChI | InChI | 1.03 | InChI=1S/C15H14N2O/c18-15-11-17(10-12-6-2-1-3-7-12)14-9-5-4-8-13(14)16-15/h1-9H,10-11H2,(H,16,18) |
| InChIKey | InChI | 1.03 | BSCQZYGHGGBKLI-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1CN(Cc2ccccc2)c3ccccc3N1 |
| SMILES | CACTVS | 3.385 | O=C1CN(Cc2ccccc2)c3ccccc3N1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)CN2CC(=O)Nc3c2cccc3 |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)CN2CC(=O)Nc3c2cccc3 |
