6871-21-2

Name asimilobine
CAS 6871-21-2
Molecular Formula C17H17NO2
MDL Number MFCD28385980
Molecular Weight 267.32
MOL File 6871-21-2.mol
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Chemical Properties

Melting point  177-179℃ (acetone )
InChI InChI=1S/C17H17NO2/c1-20-17-14(19)9-11-6-7-18-13-8-10-4-2-3-5-12(10)16(17)15(11)13/h2-5,9,13,18-19H,6-8H2,1H3/t13-/m1/s1
InChIKey NBDNEUOVIJYCGZ-CYBMUJFWSA-N
SMILES N1[C@@]2([H])C3=C(C(OC)=C(O)C=C3CC1)C1=CC=CC=C1C2

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