N-(3-morpholin-4-ium-4-ylpropyl)-6-nitro-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: N-(3-morpholin-4-ium-4-ylpropyl)-6-nitro-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-6-nitro-2-oxo-chromene-3-carboxamide CAS Name: N-[3-(4-morpholin-4-iumyl)propyl]-6-nitro-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-(3-morpholin-4-ium-4-ylpropyl)-6-nitro-2-oxochromene-3-carboxamide Traditional Name: 2-keto-N-(3-morpholin-4-ium-4-ylpropyl)-6-nitro-chromene-3-carboxamide Formula: C17H20N3O6+ MolecularWeight: 362.3572

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)C2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C17H19N3O6/c21-16(18-4-1-5-19-6-8-25-9-7-19)14-11-12-10-13(20(23)24)2-3-15(12)26-17(14)22/h2-3,10-11H,1,4-9H2,(H,18,21)/p+1