dimethyl-[3-[(3-nitro-2-oxidanylidene-chromen-4-yl)amino]propyl]azanium

Systemtic Name: dimethyl-[3-[(3-nitro-2-oxidanylidene-chromen-4-yl)amino]propyl]azanium Openeye Name: dimethyl-[3-[(3-nitro-2-oxo-chromen-4-yl)amino]propyl]ammonium CAS Name: dimethyl-[3-[(3-nitro-2-oxo-1-benzopyran-4-yl)amino]propyl]ammonium IUPAC Name: dimethyl-[3-[(3-nitro-2-oxochromen-4-yl)amino]propyl]azanium Traditional Name: 3-[(2-keto-3-nitro-chromen-4-yl)amino]propyl-dimethyl-ammonium Formula: C14H18N3O4+ MolecularWeight: 292.31042

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC1=C(C(=O)OC2=CC=CC=C21)[N+](=O)[O-]

Isomeric SMILES

C[NH+](C)CCCNC1=C(C(=O)OC2=CC=CC=C21)[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O4/c1-16(2)9-5-8-15-12-10-6-3-4-7-11(10)21-14(18)13(12)17(19)20/h3-4,6-7,15H,5,8-9H2,1-2H3/p+1