769155-87-5
1-(2-(AMINOCARBONYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3,4-DIMETHOXYBENZOATE
Name1-(2-(AMINOCARBONYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3,4-DIMETHOXYBENZOATE
1Identification
【Name】
1-(2-(AMINOCARBONYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3,4-DIMETHOXYBENZOATE
【CAS】
【MDL】
MFCD05154369
【English Synonyms】
【Formula】
C21 H19 N3 O5
【MolWeight】
393.397
【Inchi】
InChI=1S/C21H19N3O5/c1-27-18-10-8-14(11-19(18)28-2)20(25)29-17-9-7-13-5-3-4-6-15(13)16(17)12-23-24-21(22)26/h3-12H,1-2H3,(H3,22,24,26)/b23-12+
【InChIKey】
InChIKey=AFDAZMRFOZWCOE-FSJBWODESA-N
【SMILES】
COc1ccc(cc1OC)C(=O)Oc2ccc3ccccc3c2/C=N/NC(=O)N
【MOL File】
1-(2-(AMINOCARBONYL)….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:8
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-(AMINOCARBONYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3,4-DIMETHOXYBENZOATE.cml