ethyl 3-(2,2-dimethyl-1,3-dioxolan-4-yl)-3-(1H-indol-3-yl)-2-nitro-propanoate

Systemtic Name: ethyl 3-(2,2-dimethyl-1,3-dioxolan-4-yl)-3-(1H-indol-3-yl)-2-nitro-propanoate Openeye Name: ethyl 3-(2,2-dimethyl-1,3-dioxolan-4-yl)-3-(1H-indol-3-yl)-2-nitro-propanoate CAS Name: 3-(2,2-dimethyl-1,3-dioxolan-4-yl)-3-(1H-indol-3-yl)-2-nitropropanoic acid ethyl ester IUPAC Name: ethyl 3-(2,2-dimethyl-1,3-dioxolan-4-yl)-3-(1H-indol-3-yl)-2-nitropropanoate Traditional Name: 3-(2,2-dimethyl-1,3-dioxolan-4-yl)-3-(1H-indol-3-yl)-2-nitro-propionic acid ethyl ester Formula: C18H22N2O6 MolecularWeight: 362.37708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1COC(O1)(C)C)C2=CNC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(C(C1COC(O1)(C)C)C2=CNC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C18H22N2O6/c1-4-24-17(21)16(20(22)23)15(14-10-25-18(2,3)26-14)12-9-19-13-8-6-5-7-11(12)13/h5-9,14-16,19H,4,10H2,1-3H3