Vitas-M small molecule compound
2-phenylethyl 2-methyl-4-(4-nitrophenyl)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK064038
SMILES O=C(C1=C(C)NC2=C(C1c1ccc(cc1)[N+](=O)[O-])C(=O)CC(C2)c1ccccc1)OCCc1ccccc1
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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 C31H28N2O5 MW 508.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28N2O5/c1-20-28(31(35)38-17-16-21-8-4-2-5-9-21)29(23-12-14-25(15-13-23)33(36)37)30-26(32-20)18-24(19-27(30)34)22-10-6-3-7-11-22/h2-15,24,29,32H,16-19H2,1H3InChIKey
XLUZFRMFDZZCMI-UHFFFAOYSA-NSynonyms
2phenylethyl2methyl4(4nitrophenyl)5oxo7phenyl145678hexahydroquinoline3carboxylate
2phenylethyl2methyl4(4nitrophenyl)5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC=C(C=C4)(N+)(=O)(O))C(=O)OCCC5=CC=CC=C5
InChI=1SC31H28N2O5c12028(31(35)381716218425921)29(23121425(151323)33(36)37)3026(3220)1824(1927(30)34)22106371122h215242932H1619H21H3
MFCD01445594
O=C(C1=C(C)NC2=C(C1c1ccc(cc1)(N+)(=O)(O))C(=O)CC(C2)c1ccccc1)OCCc1ccccc1
STK064038
ZINC000019848735
ZINC000019848738
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