[2-(4-methyl-3-nitro-phenyl)-2-oxidanylidene-ethyl] 5-[(4-ethoxyphenyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: [2-(4-methyl-3-nitro-phenyl)-2-oxidanylidene-ethyl] 5-[(4-ethoxyphenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: [2-(4-methyl-3-nitro-phenyl)-2-oxo-ethyl] 5-(4-ethoxyanilino)-5-oxo-pentanoate CAS Name: 5-(4-ethoxyanilino)-5-oxopentanoic acid [2-(4-methyl-3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methyl-3-nitrophenyl)-2-oxoethyl] 5-(4-ethoxyanilino)-5-oxopentanoate Traditional Name: 5-keto-5-(p-phenetidino)valeric acid [2-keto-2-(4-methyl-3-nitro-phenyl)ethyl] ester Formula: C22H24N2O7 MolecularWeight: 428.43516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CCCC(=O)OCC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CCCC(=O)OCC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C22H24N2O7/c1-3-30-18-11-9-17(10-12-18)23-21(26)5-4-6-22(27)31-14-20(25)16-8-7-15(2)19(13-16)24(28)29/h7-13H,3-6,14H2,1-2H3,(H,23,26)