4-methyl-2-[5-methyl-2-[(3R)-3-methylpiperidin-1-yl]-1,3-thiazol-4-yl]-6-nitro-phenolate

Systemtic Name: 4-methyl-2-[5-methyl-2-[(3R)-3-methylpiperidin-1-yl]-1,3-thiazol-4-yl]-6-nitro-phenolate Openeye Name: 4-methyl-2-[5-methyl-2-[(3R)-3-methyl-1-piperidyl]thiazol-4-yl]-6-nitro-phenolate CAS Name: 4-methyl-2-[5-methyl-2-[(3R)-3-methyl-1-piperidinyl]-4-thiazolyl]-6-nitrophenolate IUPAC Name: 4-methyl-2-[5-methyl-2-[(3R)-3-methylpiperidin-1-yl]-1,3-thiazol-4-yl]-6-nitrophenolate Traditional Name: 4-methyl-2-[5-methyl-2-[(3R)-3-methylpiperidino]thiazol-4-yl]-6-nitro-phenolate Formula: C17H20N3O3S- MolecularWeight: 346.424

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=NC(=C(S2)C)C3=CC(=CC(=C3[O-])[N+](=O)[O-])C

Isomeric SMILES

C[C@@H]1CCCN(C1)C2=NC(=C(S2)C)C3=CC(=CC(=C3[O-])[N+](=O)[O-])C

InChI

InChI=1S/C17H21N3O3S/c1-10-5-4-6-19(9-10)17-18-15(12(3)24-17)13-7-11(2)8-14(16(13)21)20(22)23/h7-8,10,21H,4-6,9H2,1-3H3/p-1/t10-/m1/s1