Vitas-M small molecule compound

2-ethoxyethyl 4-[4-(benzyloxy)-3-methoxyphenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK003298
SMILES CCOCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)OCc1ccccc1)C(=O)CC(C2)(C)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 C31H37NO6 MW 519.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H37NO6/c1-6-36-14-15-37-30(34)27-20(2)32-23-17-31(3,4)18-24(33)29(23)28(27)22-12-13-25(26(16-22)35-5)38-19-21-10-8-7-9-11-21/h7-13,16,28,32H,6,14-15,17-19H2,1-5H3
InChIKey
SALFFZPMEAMJTM-UHFFFAOYSA-N
Synonyms

2ethoxyethyl4(3methoxy4phenylmethoxyphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
2ethoxyethyl4(4(benzyloxy)3methoxyphenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
CCOCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)OCc1ccccc1)C(=O)CC(C2)(C)C
CCOCCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)C(=O)CC(C2)(C)C)C
InChI=1SC31H37NO6c163614153730(34)2720(2)32231731(34)1824(33)29(23)28(27)22121325(26(1622)355)381921108791121h713162832H614151719H215H3
MFCD00753254
STK003298
ZINC000002055371
ZINC000002055372

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Available files

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