ethyl 3-(3-naphthalen-2-ylpropanoylamino)-4-nitro-benzoate

Systemtic Name: ethyl 3-(3-naphthalen-2-ylpropanoylamino)-4-nitro-benzoate Openeye Name: ethyl 3-[3-(2-naphthyl)propanoylamino]-4-nitro-benzoate CAS Name: 3-[[3-(2-naphthalenyl)-1-oxopropyl]amino]-4-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-(3-naphthalen-2-ylpropanoylamino)-4-nitrobenzoate Traditional Name: 3-[3-(2-naphthyl)propanoylamino]-4-nitro-benzoic acid ethyl ester Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])NC(=O)CCC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])NC(=O)CCC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H20N2O5/c1-2-29-22(26)18-10-11-20(24(27)28)19(14-18)23-21(25)12-8-15-7-9-16-5-3-4-6-17(16)13-15/h3-7,9-11,13-14H,2,8,12H2,1H3,(H,23,25)