diethyl-[2-[(6-nitro-2-oxidanylidene-chromen-3-yl)carbonylamino]ethyl]azanium

Systemtic Name: diethyl-[2-[(6-nitro-2-oxidanylidene-chromen-3-yl)carbonylamino]ethyl]azanium Openeye Name: diethyl-[2-[(6-nitro-2-oxo-chromene-3-carbonyl)amino]ethyl]ammonium CAS Name: diethyl-[2-[[(6-nitro-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]ethyl]ammonium IUPAC Name: diethyl-[2-[(6-nitro-2-oxochromene-3-carbonyl)amino]ethyl]azanium Traditional Name: diethyl-[2-[(2-keto-6-nitro-chromene-3-carbonyl)amino]ethyl]ammonium Formula: C16H20N3O5+ MolecularWeight: 334.3471

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C1=CC2=C(C=CC(=C2)[N+](=O)[O-])OC1=O

Isomeric SMILES

CC[NH+](CC)CCNC(=O)C1=CC2=C(C=CC(=C2)[N+](=O)[O-])OC1=O

InChI

InChI=1S/C16H19N3O5/c1-3-18(4-2)8-7-17-15(20)13-10-11-9-12(19(22)23)5-6-14(11)24-16(13)21/h5-6,9-10H,3-4,7-8H2,1-2H3,(H,17,20)/p+1