Vitas-M small molecule compound
(2E)-N-[3-(1,3-benzoxazol-2-yl)phenyl]-3-(3-nitrophenyl)prop-2-enamide
Catalog ID
STK324954
SMILES O=C(Nc1cccc(c1)c1nc2c(o1)cccc2)/C=C/c1cccc(c1)[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 C22H15N3O4 MW 385.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15N3O4/c26-21(12-11-15-5-3-8-18(13-15)25(27)28)23-17-7-4-6-16(14-17)22-24-19-9-1-2-10-20(19)29-22/h1-14H,(H,23,26)/b12-11+InChIKey
KTSHTAFVNYNKCZ-VAWYXSNFSA-NSynonyms
(2E)N(3(13benzoxazol2yl)phenyl)3(3nitrophenyl)prop2enamide
(E)N(3(13BENZOXAZOL2YL)PHENYL)3(3NITROPHENYL)PROP2ENAMIDE
C1=CC=C2C(=C1)N=C(O2)C3=CC(=CC=C3)NC(=O)C=CC4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC22H15N3O4c2621(12111553818(1315)25(27)28)231774616(1417)2224199121020(19)2922h114H(H2326)b1211+
MFCD01783756
O=C(Nc1cccc(c1)c1nc2c(o1)cccc2)C=Cc1cccc(c1)(N+)(=O)(O)
ZINC000001180383
ZINC01180383
ZINC1180383
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