Vitas-M small molecule compound

N-[(4-nitrophenyl)carbonyl]-beta-alanine

Catalog ID
STL170032
SMILES OC(=O)CCNC(=O)c1ccc(cc1)[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 C10H10N2O5 MW 238.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H10N2O5/c13-9(14)5-6-11-10(15)7-1-3-8(4-2-7)12(16)17/h1-4H,5-6H2,(H,11,15)(H,13,14)
InChIKey
PDTLZWITKYGYDN-UHFFFAOYSA-N
Synonyms
59642-21-6
3((4NITROBENZOYL)AMINO)PROPANOICACID
3((4NITROPHENYL)CARBONYLAMINO)PROPANOICACID
3(4NITROBENZAMIDO)PROPANOICACID
3(4NITROBENZAMIDO)PROPIONICACID
3(4NITROBENZOYLAMINO)PROPANOICACID
4NITROBENZOYLBETAALANINE
59642216
C1=CC(=CC=C1C(=O)NCCC(=O)O)(N+)(=O)(O)
InChI=1SC10H10N2O5c139(14)561110(15)7138(427)12(16)17h14H56H2(H1115)(H1314)
MFCD00009794
N((4nitrophenyl)carbonyl)betaalanine
N(4NITROBENZOYL)BALANINE
N(4NITROBENZOYL)BETAALANINE
N(4NITROBENZOYL)SZLIGALANINE
OC(=O)CCNC(=O)c1ccc(cc1)(N+)(=O)(O)
ZINC000000120070
ZINC120070

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Available files

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