Vitas-M small molecule compound
2-(4-chlorophenyl)-1-(4-ethoxyphenyl)-2-hydroxy-2,5,6,7,8,9-hexahydro-3H-imidazo[1,2-a]azepin-1-ium
Catalog ID
STL327709
SMILES CCOc1ccc(cc1)[N+]1=C2CCCCCN2CC1(O)c1ccc(cc1)Cl
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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 C22H26ClN2O2 MW 385.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26ClN2O2/c1-2-27-20-13-11-19(12-14-20)25-21-6-4-3-5-15-24(21)16-22(25,26)17-7-9-18(23)10-8-17/h7-14,26H,2-6,15-16H2,1H3/q+1InChIKey
OFMPWADIUKHQKX-UHFFFAOYSA-NSynonyms
2(4chlorophenyl)1(4ethoxyphenyl)2hydroxy256789hexahydro3Himidazo(12a)azepin1ium
2(4chlorophenyl)1(4ethoxyphenyl)2hydroxy356789hexahydro2Himidazo(12a)azepin1iumbromide
2(4chlorophenyl)1(4ethoxyphenyl)356789hexahydroimidazo(12a)azepin4ium2ol
CCOC1=CC=C(C=C1)N2C3=(N+)(CCCCC3)CC2(C4=CC=C(C=C4)Cl)O
CCOc1ccc(cc1)(N+)1=C2CCCCCN2CC1(O)c1ccc(cc1)Cl
CCOc1ccc(cc1)(N+)1=C2CCCCCN2CC1(O)c1ccc(cc1)Cl(Br)
InChI=1SC22H26ClN2O2c122720131119(121420)252164351524(21)1622(2526)177918(23)10817h71426H261516H21H3q+1
MFCD01037964
ZINC000013774206
ZINC000013774208
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