methyl (1R,2S)-1-morpholin-4-yl-2-[(1R)-2-nitro-1-phenyl-propyl]cyclopentane-1-carboxylate

Systemtic Name: methyl (1R,2S)-1-morpholin-4-yl-2-[(1R)-2-nitro-1-phenyl-propyl]cyclopentane-1-carboxylate Openeye Name: methyl (1R,2S)-1-morpholino-2-[(1R)-2-nitro-1-phenyl-propyl]cyclopentanecarboxylate CAS Name: (1R,2S)-1-(4-morpholinyl)-2-[(1R)-2-nitro-1-phenylpropyl]-1-cyclopentanecarboxylic acid methyl ester IUPAC Name: methyl (1R,2S)-1-morpholin-4-yl-2-[(1R)-2-nitro-1-phenylpropyl]cyclopentane-1-carboxylate Traditional Name: (1R,2S)-1-morpholino-2-[(1R)-2-nitro-1-phenyl-propyl]cyclopentanecarboxylic acid methyl ester Formula: C20H28N2O5 MolecularWeight: 376.44672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1CCCC1(C(=O)OC)N2CCOCC2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC([C@H]([C@@H]1CCC[C@@]1(C(=O)OC)N2CCOCC2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H28N2O5/c1-15(22(24)25)18(16-7-4-3-5-8-16)17-9-6-10-20(17,19(23)26-2)21-11-13-27-14-12-21/h3-5,7-8,15,17-18H,6,9-14H2,1-2H3/t15?,17-,18-,20+/m0/s1