methyl 4-(2-morpholin-4-ylethylamino)-3-nitro-benzoate

Systemtic Name: methyl 4-(2-morpholin-4-ylethylamino)-3-nitro-benzoate Openeye Name: methyl 4-(2-morpholinoethylamino)-3-nitro-benzoate CAS Name: 4-[2-(4-morpholinyl)ethylamino]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-(2-morpholin-4-ylethylamino)-3-nitrobenzoate Traditional Name: 4-(2-morpholinoethylamino)-3-nitro-benzoic acid methyl ester Formula: C14H19N3O5 MolecularWeight: 309.31776

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)NCCN2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)NCCN2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O5/c1-21-14(18)11-2-3-12(13(10-11)17(19)20)15-4-5-16-6-8-22-9-7-16/h2-3,10,15H,4-9H2,1H3