2-pyridin-2-ylethyl 4-morpholin-4-yl-3-nitro-benzoate

Systemtic Name: 2-pyridin-2-ylethyl 4-morpholin-4-yl-3-nitro-benzoate Openeye Name: 2-(2-pyridyl)ethyl 4-morpholino-3-nitro-benzoate CAS Name: 4-(4-morpholinyl)-3-nitrobenzoic acid 2-(2-pyridinyl)ethyl ester IUPAC Name: 2-pyridin-2-ylethyl 4-morpholin-4-yl-3-nitrobenzoate Traditional Name: 4-morpholino-3-nitro-benzoic acid 2-(2-pyridyl)ethyl ester Formula: C18H19N3O5 MolecularWeight: 357.36056

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)OCCC3=CC=CC=N3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)OCCC3=CC=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5/c22-18(26-10-6-15-3-1-2-7-19-15)14-4-5-16(17(13-14)21(23)24)20-8-11-25-12-9-20/h1-5,7,13H,6,8-12H2