methyl 3-[3-(3-oxidanylidene-4-phenethyl-quinoxalin-2-yl)propanoyloxymethyl]benzoate

Systemtic Name: methyl 3-[3-(3-oxidanylidene-4-phenethyl-quinoxalin-2-yl)propanoyloxymethyl]benzoate Openeye Name: methyl 3-[3-(3-oxo-4-phenethyl-quinoxalin-2-yl)propanoyloxymethyl]benzoate CAS Name: 3-[[1-oxo-3-(3-oxo-4-phenethyl-2-quinoxalinyl)propoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[3-(3-oxo-4-phenethylquinoxalin-2-yl)propanoyloxymethyl]benzoate Traditional Name: 3-[3-(3-keto-4-phenethyl-quinoxalin-2-yl)propanoyloxymethyl]benzoic acid methyl ester Formula: C28H26N2O5 MolecularWeight: 470.51644

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)COC(=O)CCC2=NC3=CC=CC=C3N(C2=O)CCC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)COC(=O)CCC2=NC3=CC=CC=C3N(C2=O)CCC4=CC=CC=C4

InChI

InChI=1S/C28H26N2O5/c1-34-28(33)22-11-7-10-21(18-22)19-35-26(31)15-14-24-27(32)30(17-16-20-8-3-2-4-9-20)25-13-6-5-12-23(25)29-24/h2-13,18H,14-17,19H2,1H3