4-(dimethylaminomethyl)-3-nitro-xanthen-9-one

Systemtic Name: 4-(dimethylaminomethyl)-3-nitro-xanthen-9-one Openeye Name: 4-(dimethylaminomethyl)-3-nitro-xanthen-9-one CAS Name: 4-(dimethylaminomethyl)-3-nitro-9-xanthenone IUPAC Name: 4-(dimethylaminomethyl)-3-nitroxanthen-9-one Traditional Name: 4-(dimethylaminomethyl)-3-nitro-xanthone Formula: C16H14N2O4 MolecularWeight: 298.29336

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=C(C=CC2=C1OC3=CC=CC=C3C2=O)[N+](=O)[O-]

Isomeric SMILES

CN(C)CC1=C(C=CC2=C1OC3=CC=CC=C3C2=O)[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O4/c1-17(2)9-12-13(18(20)21)8-7-11-15(19)10-5-3-4-6-14(10)22-16(11)12/h3-8H,9H2,1-2H3