ethyl 3-[(2-morpholin-4-ylcarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl)carbonyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[(2-morpholin-4-ylcarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl)carbonyl]-5-nitro-benzoate Openeye Name: ethyl 3-[2-(morpholine-4-carbonyl)-2,3-dihydro-1,4-benzoxazine-4-carbonyl]-5-nitro-benzoate CAS Name: 3-[[2-[4-morpholinyl(oxo)methyl]-2,3-dihydro-1,4-benzoxazin-4-yl]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[2-(morpholine-4-carbonyl)-2,3-dihydro-1,4-benzoxazine-4-carbonyl]-5-nitrobenzoate Traditional Name: 3-[2-(morpholine-4-carbonyl)-2,3-dihydro-1,4-benzoxazine-4-carbonyl]-5-nitro-benzoic acid ethyl ester Formula: C23H23N3O8 MolecularWeight: 469.44402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CC(OC3=CC=CC=C32)C(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CC(OC3=CC=CC=C32)C(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H23N3O8/c1-2-33-23(29)16-11-15(12-17(13-16)26(30)31)21(27)25-14-20(22(28)24-7-9-32-10-8-24)34-19-6-4-3-5-18(19)25/h3-6,11-13,20H,2,7-10,14H2,1H3