2-[2-[(3-nitro-4-piperidin-1-yl-phenyl)carbonylamino]-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[(3-nitro-4-piperidin-1-yl-phenyl)carbonylamino]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[[3-nitro-4-(1-piperidyl)benzoyl]amino]thiazol-4-yl]acetic acid CAS Name: 2-[2-[[[3-nitro-4-(1-piperidinyl)phenyl]-oxomethyl]amino]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[(3-nitro-4-piperidin-1-ylbenzoyl)amino]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[(3-nitro-4-piperidino-benzoyl)amino]thiazol-4-yl]acetic acid Formula: C17H18N4O5S MolecularWeight: 390.41362

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=NC(=CS3)CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=NC(=CS3)CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O5S/c22-15(23)9-12-10-27-17(18-12)19-16(24)11-4-5-13(14(8-11)21(25)26)20-6-2-1-3-7-20/h4-5,8,10H,1-3,6-7,9H2,(H,22,23)(H,18,19,24)