methyl 5-methyl-3-(4-nitrophenyl)-4-piperidin-1-yl-4H-1,2,3-triazole-5-carboxylate

Systemtic Name: methyl 5-methyl-3-(4-nitrophenyl)-4-piperidin-1-yl-4H-1,2,3-triazole-5-carboxylate Openeye Name: methyl 5-methyl-3-(4-nitrophenyl)-4-(1-piperidyl)-4H-triazole-5-carboxylate CAS Name: 5-methyl-3-(4-nitrophenyl)-4-(1-piperidinyl)-4H-triazole-5-carboxylic acid methyl ester IUPAC Name: methyl 5-methyl-3-(4-nitrophenyl)-4-piperidin-1-yl-4H-triazole-5-carboxylate Traditional Name: 5-methyl-3-(4-nitrophenyl)-4-piperidino-4H-triazole-5-carboxylic acid methyl ester Formula: C16H21N5O4 MolecularWeight: 347.36904

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(N=N1)C2=CC=C(C=C2)[N+](=O)[O-])N3CCCCC3)C(=O)OC

Isomeric SMILES

CC1(C(N(N=N1)C2=CC=C(C=C2)[N+](=O)[O-])N3CCCCC3)C(=O)OC

InChI

InChI=1S/C16H21N5O4/c1-16(15(22)25-2)14(19-10-4-3-5-11-19)20(18-17-16)12-6-8-13(9-7-12)21(23)24/h6-9,14H,3-5,10-11H2,1-2H3