Vitas-M small molecule compound
3-[(4-methylphenyl)carbonyl]spiro[1,3-benzoxazine-2,1'-cyclohexan]-4(3H)-one
Catalog ID
STK833569
SMILES Cc1ccc(cc1)C(=O)N1C(=O)c2ccccc2OC21CCCCC2
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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 C21H21NO3 MW 335.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO3/c1-15-9-11-16(12-10-15)19(23)22-20(24)17-7-3-4-8-18(17)25-21(22)13-5-2-6-14-21/h3-4,7-12H,2,5-6,13-14H2,1H3InChIKey
CVYFLBSLCDBCJO-UHFFFAOYSA-NSynonyms
331416-83-23((4methylphenyl)carbonyl)spiro(13benzoxazine21cyclohexan)4(3H)one
3(4METHYLBENZOYL)SPIRO(13BENZOXAZINE21CYCLOHEXANE)4ONE
3(4methylbenzoyl)spiro(benzo(e)(13)oxazine21cyclohexan)4(3H)one
331416832
CC1=CC=C(C=C1)C(=O)N2C(=O)C3=CC=CC=C3OC24CCCCC4
InChI=1SC21H21NO3c11591116(121015)19(23)2220(24)17734818(17)2521(22)135261421h34712H2561314H21H3
MFCD00689652
ZINC000000494147
ZINC00494147
ZINC494147
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