methyl (2R)-2-[(1S)-1-(4-methoxyphenyl)-2-nitro-ethyl]-3-oxidanylidene-1H-indene-2-carboxylate

Systemtic Name: methyl (2R)-2-[(1S)-1-(4-methoxyphenyl)-2-nitro-ethyl]-3-oxidanylidene-1H-indene-2-carboxylate Openeye Name: methyl (2R)-2-[(1S)-1-(4-methoxyphenyl)-2-nitro-ethyl]-1-oxo-indane-2-carboxylate CAS Name: (2R)-2-[(1S)-1-(4-methoxyphenyl)-2-nitroethyl]-3-oxo-1H-indene-2-carboxylic acid methyl ester IUPAC Name: methyl (2R)-2-[(1S)-1-(4-methoxyphenyl)-2-nitroethyl]-3-oxo-1H-indene-2-carboxylate Traditional Name: (2R)-1-keto-2-[(1S)-1-(4-methoxyphenyl)-2-nitro-ethyl]indane-2-carboxylic acid methyl ester Formula: C20H19NO6 MolecularWeight: 369.36796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C[N+](=O)[O-])C2(CC3=CC=CC=C3C2=O)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](C[N+](=O)[O-])[C@@]2(CC3=CC=CC=C3C2=O)C(=O)OC

InChI

InChI=1S/C20H19NO6/c1-26-15-9-7-13(8-10-15)17(12-21(24)25)20(19(23)27-2)11-14-5-3-4-6-16(14)18(20)22/h3-10,17H,11-12H2,1-2H3/t17-,20+/m0/s1