Cinitapride
4-amino-N-[1-(cyclohex-3-en-1-ylmethyl)piperidin-4-yl]-2-ethoxy-5-nitrobenzamide
| Molecular Formula | C21H30N4O4 |
|---|---|
| Molecular Weight | 402.5 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 113.0 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 402.2267 |
| Heavy Atoms | 29 |
| Complexity | 586.0 |
Chemical Identifiers
| CAS Number | 66564-14-5 |
|---|---|
| SMILES | CCOC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3CCC=CC3)[N+](=O)[O-])N |
| InChIKey | ZDLBNXXKDMLZMF-UHFFFAOYSA-N |
📖 Product Overview
Cinitapride (CAS: 66564-14-5) is a chemical compound with molecular formula C21H30N4O4 and molecular weight 402.5 g/mol. Its IUPAC systematic name is 4-amino-N-[1-(cyclohex-3-en-1-ylmethyl)piperidin-4-yl]-2-ethoxy-5-nitrobenzamide.
ZDLBNXXKDMLZMF-UHFFFAOYSA-N.
SMILES: CCOC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3CCC=CC3)[N+](=O)[O-])N.
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