ethyl 2-ethanoyl-3-naphthalen-2-yl-4-nitro-butanoate

Systemtic Name: ethyl 2-ethanoyl-3-naphthalen-2-yl-4-nitro-butanoate Openeye Name: ethyl 2-acetyl-3-(2-naphthyl)-4-nitro-butanoate CAS Name: 2-acetyl-3-(2-naphthalenyl)-4-nitrobutanoic acid ethyl ester IUPAC Name: ethyl 2-acetyl-3-naphthalen-2-yl-4-nitrobutanoate Traditional Name: 2-acetyl-3-(2-naphthyl)-4-nitro-butyric acid ethyl ester Formula: C18H19NO5 MolecularWeight: 329.34716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C[N+](=O)[O-])C1=CC2=CC=CC=C2C=C1)C(=O)C

Isomeric SMILES

CCOC(=O)C(C(C[N+](=O)[O-])C1=CC2=CC=CC=C2C=C1)C(=O)C

InChI

InChI=1S/C18H19NO5/c1-3-24-18(21)17(12(2)20)16(11-19(22)23)15-9-8-13-6-4-5-7-14(13)10-15/h4-10,16-17H,3,11H2,1-2H3