V16
Summary
| Name: | N-(4-butyl-2-methylphenyl)-N'-hydroxyimidoformamide |
| Formula: | C12 H18 N2 O |
| Formal charge: | 0 |
| Formula weight: | 206.284 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-(4-butyl-2-methylphenyl)-N'-hydroxyimidoformamide |
| OpenEye OEToolkits | 2.0.6 | ~{N}-(4-butyl-2-methyl-phenyl)-~{N}'-oxidanyl-methanimidamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N(c1ccc(cc1C)CCCC)[C@H]=NO |
| InChI | InChI | 1.03 | InChI=1S/C12H18N2O/c1-3-4-5-11-6-7-12(10(2)8-11)13-9-14-15/h6-9,15H,3-5H2,1-2H3,(H,13,14) |
| InChIKey | InChI | 1.03 | LYNOGBKNFIHKLE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCc1ccc(N\C=N/O)c(C)c1 |
| SMILES | CACTVS | 3.385 | CCCCc1ccc(NC=NO)c(C)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCCCc1ccc(c(c1)C)N/C=N\O |
| SMILES | OpenEye OEToolkits | 2.0.6 | CCCCc1ccc(c(c1)C)NC=NO |
