ethyl 3-[(2-chloranyl-5-nitro-phenyl)carbonylamino]-4-morpholin-4-yl-benzoate

Systemtic Name: ethyl 3-[(2-chloranyl-5-nitro-phenyl)carbonylamino]-4-morpholin-4-yl-benzoate Openeye Name: ethyl 3-[(2-chloro-5-nitro-benzoyl)amino]-4-morpholino-benzoate CAS Name: 3-[[(2-chloro-5-nitrophenyl)-oxomethyl]amino]-4-(4-morpholinyl)benzoic acid ethyl ester IUPAC Name: ethyl 3-[(2-chloro-5-nitrobenzoyl)amino]-4-morpholin-4-ylbenzoate Traditional Name: 3-[(2-chloro-5-nitro-benzoyl)amino]-4-morpholino-benzoic acid ethyl ester Formula: C20H20ClN3O6 MolecularWeight: 433.8423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H20ClN3O6/c1-2-30-20(26)13-3-6-18(23-7-9-29-10-8-23)17(11-13)22-19(25)15-12-14(24(27)28)4-5-16(15)21/h3-6,11-12H,2,7-10H2,1H3,(H,22,25)