219503-99-8
1H-INDAZOLE-1-CARBOXYLIC ACID, 6-[(2-NITROBENZOYL)AMINO]-, 1,1-DIMETHYLETHYL ESTER
Name1H-INDAZOLE-1-CARBOXYLIC ACID, 6-[(2-NITROBENZOYL)AMINO]-, 1,1-DIMETHYLETHYL ESTER
1Identification
【Name】
1H-INDAZOLE-1-CARBOXYLIC ACID, 6-[(2-NITROBENZOYL)AMINO]-, 1,1-DIMETHYLETHYL ESTER
【CAS】
【MDL】
MFCD13183041
【English Synonyms】
【Formula】
C19 H18 N4 O5
【MolWeight】
382.374
【Inchi】
InChI=1S/C19H18N4O5/c1-19(2,3)28-18(25)22-16-10-13(9-8-12(16)11-20-22)21-17(24)14-6-4-5-7-15(14)23(26)27/h4-11H,1-3H3,(H,21,24)
【InChIKey】
InChIKey=OQMVUYHONGWPGZ-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)n1c2cc(ccc2cn1)NC(=O)c3ccccc3[N+](=O)[O-]
【MOL File】
1H-INDAZOLE-1-CARBOX….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:9
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1H-INDAZOLE-1-CARBOXYLIC ACID, 6-[(2-NITROBENZOYL)AMINO]-, 1,1-DIMETHYLETHYL ESTER.cml