3-[2-(PIPERIDIN-4-YLIDENE)-6-THIATRICYCLO[8.4.0.0(3,7)]TETRADECA-1(10),3(7),4,8,11,13-HEXAEN-5-YL]PROPANOIC ACID

CAS No.
1262518-49-9
CCD No.
CCD04334010
Formula
C21 H21 N O2 S
MolWeight
351.468

Basic Information

Product Name: 3-[2-(PIPERIDIN-4-YLIDENE)-6-THIATRICYCLO[8.4.0.0(3,7)]TETRADECA-1(10),3(7),4,8,11,13-HEXAEN-5-YL]PROPANOIC ACID
CAS: 1262518-49-9
English Synonyms: 3-[2-(PIPERIDIN-4-YLIDENE)-6-THIATRICYCLO[8.4.0.0(3,7)]TETRADECA-1(10),3(7),4,8,11,13-HEXAEN-5-YL]PROPANOIC ACID
MDL Number.: MFCD18633076
H bond acceptor: 3
H bond donor: 2
Smile: c1ccc2c(c1)C=Cc3c(cc(s3)CCC(=O)O)C2=C4CCNCC4
InChi: InChI=1S/C21H21NO2S/c23-20(24)8-6-16-13-18-19(25-16)7-5-14-3-1-2-4-17(14)21(18)15-9-11-22-12-10-15/h1-5,7,13,22H,6,8-12H2,(H,23,24)
InChiKey: InChIKey=IXVZSNDGWSZZHI-UHFFFAOYSA-N

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