Vitas-M small molecule compound
methyl 4-[(3aS,4R,9bR)-6-methyl-9-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl]benzoate
Catalog ID
STL222116
SMILES COC(=O)c1ccc(cc1)[C@@H]1Nc2c(C)ccc(c2[C@H]2[C@@H]1CC=C2)[N+](=O)[O-]
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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 C21H20N2O4 MW 364.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O4/c1-12-6-11-17(23(25)26)18-15-4-3-5-16(15)20(22-19(12)18)13-7-9-14(10-8-13)21(24)27-2/h3-4,6-11,15-16,20,22H,5H2,1-2H3/t15-,16+,20+/m1/s1InChIKey
YBZYZLVFMPDZHI-GUXCAODWSA-NSynonyms
CC1=C2C(=C(C=C1)(N+)(=O)(O))C3C=CCC3C(N2)C4=CC=C(C=C4)C(=O)OC
COC(=O)c1ccc(cc1)(C@@H)1Nc2c(C)ccc(c2(C@H)2(C@@H)1CC=C2)(N+)(=O)(O)
InChI=1SC21H20N2O4c11261117(23(25)26)181543516(15)20(2219(12)18)137914(10813)21(24)272h3461115162022H5H212H3t1516+20+m1s1
methyl4((3aS4R9bR)6methyl9nitro3a459btetrahydro3Hcyclopenta(c)quinolin4yl)benzoate
MFCD24857656
ZINC000004501466
ZINC04501466
ZINC4501466
Check stock
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