methyl (2S,3S)-2-[(2-nitrophenyl)methoxy]-5-oxidanylidene-2,3,5-triphenyl-pentanoate

Systemtic Name: methyl (2S,3S)-2-[(2-nitrophenyl)methoxy]-5-oxidanylidene-2,3,5-triphenyl-pentanoate Openeye Name: methyl (2S,3S)-2-[(2-nitrophenyl)methoxy]-5-oxo-2,3,5-triphenyl-pentanoate CAS Name: (2S,3S)-2-[(2-nitrophenyl)methoxy]-5-oxo-2,3,5-triphenylpentanoic acid methyl ester IUPAC Name: methyl (2S,3S)-2-[(2-nitrophenyl)methoxy]-5-oxo-2,3,5-triphenylpentanoate Traditional Name: (2S,3S)-5-keto-2-(2-nitrobenzyl)oxy-2,3,5-triphenyl-valeric acid methyl ester Formula: C31H27NO6 MolecularWeight: 509.54918

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)(C(CC(=O)C2=CC=CC=C2)C3=CC=CC=C3)OCC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

COC(=O)[C@@](C1=CC=CC=C1)([C@@H](CC(=O)C2=CC=CC=C2)C3=CC=CC=C3)OCC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C31H27NO6/c1-37-30(34)31(26-18-9-4-10-19-26,38-22-25-17-11-12-20-28(25)32(35)36)27(23-13-5-2-6-14-23)21-29(33)24-15-7-3-8-16-24/h2-20,27H,21-22H2,1H3/t27-,31+/m0/s1