methyl 6-[(5-nitro-2-phenylmethoxy-phenyl)methylamino]pyridine-3-carboxylate

Systemtic Name: methyl 6-[(5-nitro-2-phenylmethoxy-phenyl)methylamino]pyridine-3-carboxylate Openeye Name: methyl 6-[(2-benzyloxy-5-nitro-phenyl)methylamino]pyridine-3-carboxylate CAS Name: 6-[(5-nitro-2-phenylmethoxyphenyl)methylamino]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[(5-nitro-2-phenylmethoxyphenyl)methylamino]pyridine-3-carboxylate Traditional Name: 6-[(2-benzoxy-5-nitro-benzyl)amino]nicotinic acid methyl ester Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(C=C1)NCC2=C(C=CC(=C2)[N+](=O)[O-])OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CN=C(C=C1)NCC2=C(C=CC(=C2)[N+](=O)[O-])OCC3=CC=CC=C3

InChI

InChI=1S/C21H19N3O5/c1-28-21(25)16-7-10-20(22-12-16)23-13-17-11-18(24(26)27)8-9-19(17)29-14-15-5-3-2-4-6-15/h2-12H,13-14H2,1H3,(H,22,23)