methyl 3-[4-(2,3-dihydro-1H-inden-2-yloxy)-3-(1-methylindazol-5-yl)-5-nitro-phenyl]propanoate

Systemtic Name: methyl 3-[4-(2,3-dihydro-1H-inden-2-yloxy)-3-(1-methylindazol-5-yl)-5-nitro-phenyl]propanoate Openeye Name: methyl 3-[4-indan-2-yloxy-3-(1-methylindazol-5-yl)-5-nitro-phenyl]propanoate CAS Name: 3-[4-(2,3-dihydro-1H-inden-2-yloxy)-3-(1-methyl-5-indazolyl)-5-nitrophenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-(2,3-dihydro-1H-inden-2-yloxy)-3-(1-methylindazol-5-yl)-5-nitrophenyl]propanoate Traditional Name: 3-[4-indan-2-yloxy-3-(1-methylindazol-5-yl)-5-nitro-phenyl]propionic acid methyl ester Formula: C27H25N3O5 MolecularWeight: 471.5045

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C3=CC(=CC(=C3OC4CC5=CC=CC=C5C4)[N+](=O)[O-])CCC(=O)OC)C=N1

Isomeric SMILES

CN1C2=C(C=C(C=C2)C3=CC(=CC(=C3OC4CC5=CC=CC=C5C4)[N+](=O)[O-])CCC(=O)OC)C=N1

InChI

InChI=1S/C27H25N3O5/c1-29-24-9-8-20(13-21(24)16-28-29)23-11-17(7-10-26(31)34-2)12-25(30(32)33)27(23)35-22-14-18-5-3-4-6-19(18)15-22/h3-6,8-9,11-13,16,22H,7,10,14-15H2,1-2H3