765913-06-2
1-(2-(3,4-DIMETHOXYBENZOYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3,4-DIMETHOXYBENZOATE
Name1-(2-(3,4-DIMETHOXYBENZOYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3,4-DIMETHOXYBENZOATE
1Identification
【Name】
1-(2-(3,4-DIMETHOXYBENZOYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3,4-DIMETHOXYBENZOATE
【CAS】
【MDL】
MFCD05154539
【English Synonyms】
【Formula】
C29 H26 N2 O7
【MolWeight】
514.531
【Inchi】
InChI=1S/C29H26N2O7/c1-34-24-13-10-19(15-26(24)36-3)28(32)31-30-17-22-21-8-6-5-7-18(21)9-12-23(22)38-29(33)20-11-14-25(35-2)27(16-20)37-4/h5-17H,1-4H3,(H,31,32)/b30-17+
【InChIKey】
InChIKey=PBXMOTKLNXWFHM-OCSSWDANSA-N
【SMILES】
COc1ccc(cc1OC)C(=O)N/N=C/c2c3ccccc3ccc2OC(=O)c4ccc(c(c4)OC)OC
【MOL File】
1-(2-(3,4-DIMETHOXYB….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:9
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-(3,4-DIMETHOXYBENZOYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3,4-DIMETHOXYBENZOATE.cml