SpectraBase Compound ID | B2au1JcMJe5 |
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InChI | InChI=1S/C23H32N4O3/c1-30-23(29)22-21(18-9-5-6-10-19(18)24-22)25-20(28)11-12-26-13-15-27(16-14-26)17-7-3-2-4-8-17/h5-6,9-10,17,24H,2-4,7-8,11-16H2,1H3,(H,25,28) |
InChIKey | HXLSTRUOQIOACT-UHFFFAOYSA-N |
Mol Weight | 412.5 g/mol |
Molecular Formula | C23H32N4O3 |
Exact Mass | 412.247441 g/mol |
SpectraBase Spectrum ID | Fq7u7qq9V4H |
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Name | Methyl 3-{[3-(4-cyclohexyl-1-piperazinyl)propanoyl]amino}-1H-indole-2-carboxylate |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 412.247440903 u |
Formula | C23H32N4O3 |
InChI | InChI=1S/C23H32N4O3/c1-30-23(29)22-21(18-9-5-6-10-19(18)24-22)25-20(28)11-12-26-13-15-27(16-14-26)17-7-3-2-4-8-17/h5-6,9-10,17,24H,2-4,7-8,11-16H2,1H3,(H,25,28) |
InChIKey | HXLSTRUOQIOACT-UHFFFAOYSA-N |
Molecular Weight | 412.534 g/mol |
SMILES | N1C=2C=CC=CC2C(=C1C(=O)OC)NC(CCN1CCN(CC1)C1CCCCC1)=O |