3-azanyl-1-(2-dimethylaminoethylamino)-4-nitro-xanthen-9-one

Systemtic Name: 3-azanyl-1-(2-dimethylaminoethylamino)-4-nitro-xanthen-9-one Openeye Name: 3-amino-1-(2-dimethylaminoethylamino)-4-nitro-xanthen-9-one CAS Name: 3-amino-1-(2-dimethylaminoethylamino)-4-nitro-9-xanthenone IUPAC Name: 3-amino-1-(2-dimethylaminoethylamino)-4-nitroxanthen-9-one Traditional Name: 3-amino-1-(2-dimethylaminoethylamino)-4-nitro-xanthone Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC1=CC(=C(C2=C1C(=O)C3=CC=CC=C3O2)[N+](=O)[O-])N

Isomeric SMILES

CN(C)CCNC1=CC(=C(C2=C1C(=O)C3=CC=CC=C3O2)[N+](=O)[O-])N

InChI

InChI=1S/C17H18N4O4/c1-20(2)8-7-19-12-9-11(18)15(21(23)24)17-14(12)16(22)10-5-3-4-6-13(10)25-17/h3-6,9,19H,7-8,18H2,1-2H3