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4-[methyl-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]butanoic acid

4-[methyl-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]butanoic acid

Systemtic Name:4-[methyl-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]butanoic acid
Openeye Name:4-[methyl-[4-(3-nitrophenyl)thiazol-2-yl]amino]butanoic acid
CAS Name:4-[methyl-[4-(3-nitrophenyl)-2-thiazolyl]amino]butanoic acid
IUPAC Name:4-[methyl-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]butanoic acid
Traditional Name:4-[methyl-[4-(3-nitrophenyl)thiazol-2-yl]amino]butyric acid
Formula: C14H15N3O4S
MolecularWeight: 321.3516
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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C1=NC(=CS1)C2=CC(=CC=C2)[N+](=O)[O-]


Isomeric SMILES

CN(CCCC(=O)O)C1=NC(=CS1)C2=CC(=CC=C2)[N+](=O)[O-]


InChI

InChI=1S/C14H15N3O4S/c1-16(7-3-6-13(18)19)14-15-12(9-22-14)10-4-2-5-11(8-10)17(20)21/h2,4-5,8-9H,3,6-7H2,1H3,(H,18,19)


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