4-METHOXY-3-(4-NITRO-PYRAZOL-1-YLMETHYL)-BENZOIC ACID

CAS No.
956204-53-8
CCD No.
CCD00547138
Formula
C12 H11 N3 O5
MolWeight
277.235

Basic Information

Product Name: 4-METHOXY-3-(4-NITRO-PYRAZOL-1-YLMETHYL)-BENZOIC ACID
CAS: 956204-53-8
English Synonyms: 4-METHOXY-3-[(4-NITRO-1H-PYRAZOL-1-YL)METHYL]BENZOIC ACID ; 4-METHOXY-3-(4-NITRO-PYRAZOL-1-YLMETHYL)-BENZOIC ACID
MDL Number.: MFCD06653192
H bond acceptor: 8
H bond donor: 1
Smile: COc1ccc(cc1Cn2cc(cn2)[N+](=O)[O-])C(=O)O
InChi: InChI=1S/C12H11N3O5/c1-20-11-3-2-8(12(16)17)4-9(11)6-14-7-10(5-13-14)15(18)19/h2-5,7H,6H2,1H3,(H,16,17)
InChiKey: InChIKey=SMTTWBNEGXXXDN-UHFFFAOYSA-N

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