2-diethylaminoethyl 6-nitro-2-oxidanylidene-chromene-3-carboxylate chloride

Systemtic Name: 2-diethylaminoethyl 6-nitro-2-oxidanylidene-chromene-3-carboxylate chloride Openeye Name: 2-diethylaminoethyl 6-nitro-2-oxo-chromene-3-carboxylate chloride CAS Name: 6-nitro-2-oxo-1-benzopyran-3-carboxylic acid 2-diethylaminoethyl ester chloride IUPAC Name: 2-diethylaminoethyl 6-nitro-2-oxochromene-3-carboxylate chloride Traditional Name: 2-keto-6-nitro-chromene-3-carboxylic acid 2-diethylaminoethyl ester chloride Formula: C16H18ClN2O6- MolecularWeight: 369.77692

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC2=C(C=CC(=C2)[N+](=O)[O-])OC1=O.[Cl-]

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC2=C(C=CC(=C2)[N+](=O)[O-])OC1=O.[Cl-]

InChI

InChI=1S/C16H18N2O6.ClH/c1-3-17(4-2)7-8-23-15(19)13-10-11-9-12(18(21)22)5-6-14(11)24-16(13)20;/h5-6,9-10H,3-4,7-8H2,1-2H3;1H/p-1