methyl 3-[4-cyclohexyloxy-3-(1-methylindol-5-yl)-5-nitro-phenyl]propanoate

Systemtic Name: methyl 3-[4-cyclohexyloxy-3-(1-methylindol-5-yl)-5-nitro-phenyl]propanoate Openeye Name: methyl 3-[4-(cyclohexoxy)-3-(1-methylindol-5-yl)-5-nitro-phenyl]propanoate CAS Name: 3-[4-cyclohexyloxy-3-(1-methyl-5-indolyl)-5-nitrophenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-cyclohexyloxy-3-(1-methylindol-5-yl)-5-nitrophenyl]propanoate Traditional Name: 3-[4-(cyclohexoxy)-3-(1-methylindol-5-yl)-5-nitro-phenyl]propionic acid methyl ester Formula: C25H28N2O5 MolecularWeight: 436.50022

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=CC(=C2)C3=CC(=CC(=C3OC4CCCCC4)[N+](=O)[O-])CCC(=O)OC

Isomeric SMILES

CN1C=CC2=C1C=CC(=C2)C3=CC(=CC(=C3OC4CCCCC4)[N+](=O)[O-])CCC(=O)OC

InChI

InChI=1S/C25H28N2O5/c1-26-13-12-19-16-18(9-10-22(19)26)21-14-17(8-11-24(28)31-2)15-23(27(29)30)25(21)32-20-6-4-3-5-7-20/h9-10,12-16,20H,3-8,11H2,1-2H3