2-[[5-[(4-nitrophenyl)methyl]-4-propyl-1,3-thiazol-2-yl]amino]ethanoate

Systemtic Name: 2-[[5-[(4-nitrophenyl)methyl]-4-propyl-1,3-thiazol-2-yl]amino]ethanoate Openeye Name: 2-[[5-[(4-nitrophenyl)methyl]-4-propyl-thiazol-2-yl]amino]acetate CAS Name: 2-[[5-[(4-nitrophenyl)methyl]-4-propyl-2-thiazolyl]amino]acetate IUPAC Name: 2-[[5-[(4-nitrophenyl)methyl]-4-propyl-1,3-thiazol-2-yl]amino]acetate Traditional Name: 2-[[5-(4-nitrobenzyl)-4-propyl-thiazol-2-yl]amino]acetate Formula: C15H16N3O4S- MolecularWeight: 334.37024

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(SC(=N1)NCC(=O)[O-])CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCC1=C(SC(=N1)NCC(=O)[O-])CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O4S/c1-2-3-12-13(23-15(17-12)16-9-14(19)20)8-10-4-6-11(7-5-10)18(21)22/h4-7H,2-3,8-9H2,1H3,(H,16,17)(H,19,20)/p-1