Vitas-M small molecule compound
2-phenylethyl 4-[4-(dimethylamino)phenyl]-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363392
SMILES CN(c1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCCc1ccccc1)C
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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 C27H30N2O3 MW 430.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2O3/c1-18-24(27(31)32-17-16-19-8-5-4-6-9-19)25(20-12-14-21(15-13-20)29(2)3)26-22(28-18)10-7-11-23(26)30/h4-6,8-9,12-15,25,28H,7,10-11,16-17H2,1-3H3InChIKey
XXQFZXIRZFSRKF-UHFFFAOYSA-NSynonyms
2phenylethyl4(4(dimethylamino)phenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2phenylethyl4(4(dimethylamino)phenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)N(C)C)C(=O)OCCC4=CC=CC=C4
InChI=1SC27H30N2O3c11824(27(31)321716198546919)25(20121421(151320)29(2)3)2622(2818)1071123(26)30h468912152528H710111617H213H3
MFCD01367246
ZINC000019827680
ZINC000019827684
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