Vitas-M small molecule compound
12-chloro-3-(3,4-dimethoxyphenyl)-3,4,7,8,9,10-hexahydro-2H,6H-benzo[3,4]chromeno[8,7-e][1,3]oxazin-6-one
Catalog ID
STK600661
SMILES COc1cc(ccc1OC)N1COc2c(C1)c1oc(=O)c3c(c1cc2Cl)CCCC3
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C23H22ClNO5 MW 427.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClNO5/c1-27-19-8-7-13(9-20(19)28-2)25-11-17-21-16(10-18(24)22(17)29-12-25)14-5-3-4-6-15(14)23(26)30-21/h7-10H,3-6,11-12H2,1-2H3InChIKey
WMPXRNRYUKDMCN-UHFFFAOYSA-NSynonyms
877781-71-012chloro3(34dimethoxyphenyl)2478910hexahydroisochromeno(34f)(13)benzoxazin6one
12chloro3(34dimethoxyphenyl)3478910hexahydro2H6Hbenzo(34)chromeno(87e)(13)oxazin6one
12chloro3(34dimethoxyphenyl)3478910hexahydrobenzo(34)chromeno(87e)(13)oxazin6(2H)one
877781710
COC1=C(C=C(C=C1)N2CC3=C4C(=CC(=C3OC2)Cl)C5=C(CCCC5)C(=O)O4)OC
InChI=1SC23H22ClNO5c127198713(920(19)282)2511172116(1018(24)22(17)291225)14534615(14)23(26)3021h710H361112H212H3
MFCD05700510
ZINC000009293329
ZINC09293329
ZINC9293329
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