2-(1,2,3,4-TETRAHYDROQUINOLIN-2-ON-6-YL)-3,4-DIAZABICYCLO(4.1.0)HEPT-2-EN-5-ONE HYDRATE (4:1)

CAS No.
85123-67-7
CCD No.
CCD00251065
Formula
C14 H13 N3 O2 . H2 O
MolWeight
273.29

Basic Information

Product Name: 2-(1,2,3,4-TETRAHYDROQUINOLIN-2-ON-6-YL)-3,4-DIAZABICYCLO(4.1.0)HEPT-2-EN-5-ONE HYDRATE (4:1)
CAS: 85123-67-7
English Synonyms: 2-(1,2,3,4-TETRAHYDROQUINOLIN-2-ON-6-YL)-3,4-DIAZABICYCLO(4.1.0)HEPT-2-EN-5-ONE HYDRATE (4:1)
MDL Number.: MFCD01752365
H bond acceptor: 5
H bond donor: 2
Smile: c1cc2c(cc1C3=NNC(=O)C4C3C4)CCC(=O)N2.O
InChi: InChI=1S/C14H13N3O2.H2O/c18-12-4-2-7-5-8(1-3-11(7)15-12)13-9-6-10(9)14(19)17-16-13;/h1,3,5,9-10H,2,4,6H2,(H,15,18)(H,17,19);1H2
InChiKey: InChIKey=CUKOULWPUMREQF-UHFFFAOYSA-N

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