methyl (2R,4S)-6-methyl-2,4-bis(2-nitropyridin-3-yl)-1,2,3,4-tetrahydropyridine-5-carboxylate

Systemtic Name: methyl (2R,4S)-6-methyl-2,4-bis(2-nitropyridin-3-yl)-1,2,3,4-tetrahydropyridine-5-carboxylate Openeye Name: methyl (2R,4S)-6-methyl-2,4-bis(2-nitro-3-pyridyl)-1,2,3,4-tetrahydropyridine-5-carboxylate CAS Name: (2R,4S)-6-methyl-2,4-bis(2-nitro-3-pyridinyl)-1,2,3,4-tetrahydropyridine-5-carboxylic acid methyl ester IUPAC Name: methyl (2R,4S)-6-methyl-2,4-bis(2-nitropyridin-3-yl)-1,2,3,4-tetrahydropyridine-5-carboxylate Traditional Name: (2R,4S)-6-methyl-2,4-bis(2-nitro-3-pyridyl)-1,2,3,4-tetrahydropyridine-5-carboxylic acid methyl ester Formula: C18H17N5O6 MolecularWeight: 399.35748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC(N1)C2=C(N=CC=C2)[N+](=O)[O-])C3=C(N=CC=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C([C@@H](C[C@@H](N1)C2=C(N=CC=C2)[N+](=O)[O-])C3=C(N=CC=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H17N5O6/c1-10-15(18(24)29-2)13(11-5-3-7-19-16(11)22(25)26)9-14(21-10)12-6-4-8-20-17(12)23(27)28/h3-8,13-14,21H,9H2,1-2H3/t13-,14+/m0/s1