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

Systemtic Name: 4-(diethylaminomethyl)-3-nitro-xanthen-9-one Openeye Name: 4-(diethylaminomethyl)-3-nitro-xanthen-9-one CAS Name: 4-(diethylaminomethyl)-3-nitro-9-xanthenone IUPAC Name: 4-(diethylaminomethyl)-3-nitroxanthen-9-one Traditional Name: 4-(diethylaminomethyl)-3-nitro-xanthone Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O4/c1-3-19(4-2)11-14-15(20(22)23)10-9-13-17(21)12-7-5-6-8-16(12)24-18(13)14/h5-10H,3-4,11H2,1-2H3