VBQ
Summary
Name: | 2-[(9-oxidanylidenefluoren-4-yl)carbonylamino]ethanoic acid |
Formula: | C16 H11 N O4 |
Formal charge: | 0 |
Formula weight: | 281.263 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 2-[(9-oxidanylidenefluoren-4-yl)carbonylamino]ethanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C16H11NO4/c18-13(19)8-17-16(21)12-7-3-6-11-14(12)9-4-1-2-5-10(9)15(11)20/h1-7H,8H2,(H,17,21)(H,18,19) |
InChIKey | InChI | 1.03 | XIDITRUNIYHCDR-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)CNC(=O)c1cccc2C(=O)c3ccccc3c12 |
SMILES | CACTVS | 3.385 | OC(=O)CNC(=O)c1cccc2C(=O)c3ccccc3c12 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)-c3c(cccc3C(=O)NCC(=O)O)C2=O |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)-c3c(cccc3C(=O)NCC(=O)O)C2=O |