ethyl 3-[5-(naphthalen-1-ylmethoxy)-1H-indol-3-yl]-2-nitro-pentanoate

Systemtic Name: ethyl 3-[5-(naphthalen-1-ylmethoxy)-1H-indol-3-yl]-2-nitro-pentanoate Openeye Name: ethyl 3-[5-(1-naphthylmethoxy)-1H-indol-3-yl]-2-nitro-pentanoate CAS Name: 3-[5-(1-naphthalenylmethoxy)-1H-indol-3-yl]-2-nitropentanoic acid ethyl ester IUPAC Name: ethyl 3-[5-(naphthalen-1-ylmethoxy)-1H-indol-3-yl]-2-nitropentanoate Traditional Name: 3-[5-(1-naphthylmethoxy)-1H-indol-3-yl]-2-nitro-valeric acid ethyl ester Formula: C26H26N2O5 MolecularWeight: 446.49504

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CNC2=C1C=C(C=C2)OCC3=CC=CC4=CC=CC=C43)C(C(=O)OCC)[N+](=O)[O-]

Isomeric SMILES

CCC(C1=CNC2=C1C=C(C=C2)OCC3=CC=CC4=CC=CC=C43)C(C(=O)OCC)[N+](=O)[O-]

InChI

InChI=1S/C26H26N2O5/c1-3-20(25(28(30)31)26(29)32-4-2)23-15-27-24-13-12-19(14-22(23)24)33-16-18-10-7-9-17-8-5-6-11-21(17)18/h5-15,20,25,27H,3-4,16H2,1-2H3