2-ethanoyl-3-[(3-ethylphenyl)amino]-7-nitro-inden-1-one

Systemtic Name: 2-ethanoyl-3-[(3-ethylphenyl)amino]-7-nitro-inden-1-one Openeye Name: 2-acetyl-3-(3-ethylanilino)-7-nitro-inden-1-one CAS Name: 2-acetyl-3-(3-ethylanilino)-7-nitro-1-indenone IUPAC Name: 2-acetyl-3-(3-ethylanilino)-7-nitroinden-1-one Traditional Name: 2-acetyl-3-(3-ethylanilino)-7-nitro-inden-1-one Formula: C19H16N2O4 MolecularWeight: 336.34134

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC2=C(C(=O)C3=C2C=CC=C3[N+](=O)[O-])C(=O)C

Isomeric SMILES

CCC1=CC(=CC=C1)NC2=C(C(=O)C3=C2C=CC=C3[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C19H16N2O4/c1-3-12-6-4-7-13(10-12)20-18-14-8-5-9-15(21(24)25)17(14)19(23)16(18)11(2)22/h4-10,20H,3H2,1-2H3