2-[(2-chloranyl-5-nitro-phenyl)sulfonylamino]-N-(3-morpholin-4-ylpropyl)benzenecarboximidate

Systemtic Name: 2-[(2-chloranyl-5-nitro-phenyl)sulfonylamino]-N-(3-morpholin-4-ylpropyl)benzenecarboximidate Openeye Name: 2-[(2-chloro-5-nitro-phenyl)sulfonylamino]-N-(3-morpholinopropyl)benzenecarboximidate CAS Name: 2-[(2-chloro-5-nitrophenyl)sulfonylamino]-N-[3-(4-morpholinyl)propyl]benzenecarboximidate IUPAC Name: 2-[(2-chloro-5-nitrophenyl)sulfonylamino]-N-(3-morpholin-4-ylpropyl)benzenecarboximidate Traditional Name: 2-[(2-chloro-5-nitro-phenyl)sulfonylamino]-N-(3-morpholinopropyl)benzenecarboximidate Formula: C20H22ClN4O6S- MolecularWeight: 481.92988

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN=C(C2=CC=CC=C2NS(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)[O-]

Isomeric SMILES

C1COCCN1CCCN=C(C2=CC=CC=C2NS(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)[O-]

InChI

InChI=1S/C20H23ClN4O6S/c21-17-7-6-15(25(27)28)14-19(17)32(29,30)23-18-5-2-1-4-16(18)20(26)22-8-3-9-24-10-12-31-13-11-24/h1-2,4-7,14,23H,3,8-13H2,(H,22,26)/p-1